ZINC 12

User Information

Not Authenticated — sign in

Active cart: Temporary Cart (0 items)

Navigation

About
- ZINC
- BCIRC
- Irwin Lab
- Shoichet Lab
- UCSF
- Acknowledgements
- Facts
- Usage
Search
- By:
- Text
- Structure
- Properties
- Catalogs
- ZINC
- Targets
- Rings
- Combination
Subsets
- By:
- Catalog
- Property
- Target
- Ring
- Cart
Help
- Introduction
- FAQ
- Scripting/API
- Quick Search
- Problems
- Filtering
- History
Social
- ZINC Fans
- Decoy Club
- DOCK Fans
- Facebook
- Twitter
- Blog
- Linkedin
Quick Search ZINC ID or SMILES

Results
Query Details

Page Size:

Format: Representations: Purchasability:

ZINC Item

Suppliers, Protomers, & Similar Substances

8980501

Analogs

16625945
16625948

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-acetylphenyl)-2-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylmethyl-methyl-amino]-acetamide N-(3-acetylphenyl)-2-[[4-chloro-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.06	2.12	-63.08	3	6	1	79	442.845	8	↓ MOL2 SDF SMILES Flexibase

52896239

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[[2-(2-methylanilino)-2-oxo-ethyl]-propyl-amino]acetyl]amino]benzamide 2-[[2-[[2-(2-methylanilino)-2-ox…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.73	6.55	-41.58	5	7	1	106	383.472	9	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.55	5.81	-33.75	4	7	0	112	382.464	9	↓ MOL2 SDF SMILES Flexibase

52916601

Analogs

15442275

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[[2-(2,6-difluoroanilino)-2-oxo-ethyl]-ethyl-amino]acetyl]amino]benzamide 2-[[2-[[2-(2,6-difluoroanilino)-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.06	5.12	-40.08	5	7	1	106	391.398	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.88	2.34	-66.57	3	7	-1	111	389.382	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.88	1.94	-58.26	3	7	-1	111	389.382	8	↓ MOL2 SDF SMILES Flexibase

52916605

Analogs

25944458

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[ethyl-[2-(3-methoxyanilino)-2-oxo-ethyl]amino]acetyl]amino]benzamide 2-[[2-[ethyl-[2-(3-methoxyanilin…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.86	4.27	-41.78	5	8	1	115	385.444	9	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.68	3.5	-35.25	4	8	0	121	384.436	9	↓ MOL2 SDF SMILES Flexibase

18941371

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[2-[(4-fluorophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[4-(isopropylsulfamoyl)phenyl]propan (2R)-2-[[2-[(4-fluorophenyl)amin…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.55	5.1	-57.77	4	8	1	109	451.544	9	↓ MOL2 SDF SMILES Flexibase

18941372

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-[(4-fluorophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[4-(isopropylsulfamoyl)phenyl]propan (2S)-2-[[2-[(4-fluorophenyl)amin…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.55	5.13	-56.49	4	8	1	109	451.544	9	↓ MOL2 SDF SMILES Flexibase

12538010

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(5-chloro-2-nitro-phenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[4-chloro-3-(trifluoromethyl)phe 2-[[2-[(5-chloro-2-nitro-phenyl)…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.75	10.02	-59.44	3	8	1	108	480.25	8	↓ MOL2 SDF SMILES Flexibase

23038242

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-(ethyl-(o-tolyl)amino)-2-oxo-ethyl]-propyl-amino]-N-(o-tolyl)acetamide 2-[[2-(ethyl-(o-tolyl)amino)-2-o…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.62	12.7	-53.77	2	5	1	54	382.528	9	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.62	10.54	-21.85	1	5	0	53	381.52	9	↓ MOL2 SDF SMILES Flexibase

23038450

Analogs

16625484

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-2-oxo-ethyl]-methyl-amino]-N-(2,4-dimethylphenyl)a 2-[[2-[[4-chloro-3-(trifluoromet…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.01	9.97	-62.13	3	5	1	63	428.862	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	5.01	7.72	-22.52	2	5	0	61	427.854	7	↓ MOL2 SDF SMILES Flexibase

23038451

Analogs

16625976

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[methyl-[2-[(2-nitrophenyl)amino]-2-oxo-ethyl]amino]acetami N-[4-chloro-3-(trifluoromethyl)p…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.10	9.55	-61.06	3	8	1	108	445.805	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.10	7.28	-19.62	2	8	0	107	444.797	8	↓ MOL2 SDF SMILES Flexibase

23038452

Analogs

16625616
16625619

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-2-oxo-ethyl]-methyl-amino]-N-(3-nitrophenyl)p (2R)-2-[[2-[[4-chloro-3-(trifluo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.08	9.54	-64.64	3	8	1	108	459.832	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.08	7.33	-22.08	2	8	0	107	458.824	8	↓ MOL2 SDF SMILES Flexibase

23038453

Analogs

16625616
16625619

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-2-oxo-ethyl]-methyl-amino]-N-(3-nitrophenyl)p (2S)-2-[[2-[[4-chloro-3-(trifluo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.08	9.55	-65.23	3	8	1	108	459.832	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.08	7.37	-22.62	2	8	0	107	458.824	8	↓ MOL2 SDF SMILES Flexibase

23038455

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-2-oxo-ethyl]-methyl-amino]-N-(2,3,4-trifluoro (2R)-2-[[2-[[4-chloro-3-(trifluo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.50	9.03	-55.68	3	5	1	63	468.805	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.50	6.84	-15.25	2	5	0	61	467.797	7	↓ MOL2 SDF SMILES Flexibase

23038456

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-2-oxo-ethyl]-methyl-amino]-N-(2,3,4-trifluoro (2S)-2-[[2-[[4-chloro-3-(trifluo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.50	9.04	-55.81	3	5	1	63	468.805	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.50	6.85	-15.61	2	5	0	61	467.797	7	↓ MOL2 SDF SMILES Flexibase

23038613

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[4-(difluoromethoxy)phenyl]propanamid (2R)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.02	7.77	-53.4	3	6	1	72	457.295	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.02	5.56	-23.27	2	6	0	71	456.287	8	↓ MOL2 SDF SMILES Flexibase

23038614

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[4-(difluoromethoxy)phenyl]propanamid (2S)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.02	7.8	-53.73	3	6	1	72	457.295	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.02	5.62	-23.85	2	6	0	71	456.287	8	↓ MOL2 SDF SMILES Flexibase

23038615

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[2-(difluoromethylsulfanyl)phenyl]acetamid 2-[[2-[(2-bromophenyl)amino]-2-o…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.39	9.26	-53.64	3	5	1	63	459.336	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.39	7.02	-18.73	2	5	0	61	458.328	8	↓ MOL2 SDF SMILES Flexibase

23038646

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[2-(trifluoromethyl)phenyl]propanamid (2R)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.26	9.47	-40.69	3	5	1	63	459.286	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.26	7.31	-12.61	2	5	0	61	458.278	7	↓ MOL2 SDF SMILES Flexibase

23038647

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[2-(trifluoromethyl)phenyl]propanamid (2S)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.26	9.51	-45.05	3	5	1	63	459.286	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.26	7.33	-15.49	2	5	0	61	458.278	7	↓ MOL2 SDF SMILES Flexibase

23038648

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2-isopropylphenyl)propanamide (2R)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.40	10.33	-43.02	3	5	1	63	433.37	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.40	8.13	-18.03	2	5	0	61	432.362	7	↓ MOL2 SDF SMILES Flexibase

23038649

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2-isopropylphenyl)propanamide (2S)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.40	10.38	-41.65	3	5	1	63	433.37	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.40	8.16	-18.32	2	5	0	61	432.362	7	↓ MOL2 SDF SMILES Flexibase

23038650

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(3-chloro-4-fluoro-phenyl)propanamide (2R)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.18	8.77	-53.27	3	5	1	63	443.724	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.18	6.54	-18.15	2	5	0	61	442.716	6	↓ MOL2 SDF SMILES Flexibase

23038651

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(3-chloro-4-fluoro-phenyl)propanamide (2S)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.18	8.81	-55.18	3	5	1	63	443.724	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.18	6.63	-22.47	2	5	0	61	442.716	6	↓ MOL2 SDF SMILES Flexibase

23038652

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-(4-bromo-2-fluoro-phenyl)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]propanamide (2R)-N-(4-bromo-2-fluoro-phenyl)…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.31	8.94	-48.46	3	5	1	63	488.175	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.31	6.71	-15.1	2	5	0	61	487.167	6	↓ MOL2 SDF SMILES Flexibase

23038653

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-(4-bromo-2-fluoro-phenyl)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]propanamide (2S)-N-(4-bromo-2-fluoro-phenyl)…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.31	8.96	-48.7	3	5	1	63	488.175	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.31	6.78	-15.23	2	5	0	61	487.167	6	↓ MOL2 SDF SMILES Flexibase

23038656

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2-ethoxyphenyl)propanamide (2R)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.79	8.58	-39.79	3	6	1	72	435.342	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.79	6.43	-13.38	2	6	0	71	434.334	8	↓ MOL2 SDF SMILES Flexibase

23038657

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2-ethoxyphenyl)propanamide (2S)-2-[[2-[(2-bromophenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.79	8.61	-45.83	3	6	1	72	435.342	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.79	6.42	-17.6	2	6	0	71	434.334	8	↓ MOL2 SDF SMILES Flexibase

23038679

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-bromophenyl)-2-[[2-[(5-chloro-2,4-dimethoxy-phenyl)amino]-2-oxo-ethyl]-methyl-amino]acetamide N-(2-bromophenyl)-2-[[2-[(5-chlo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.09	7.17	-54.49	3	7	1	81	471.759	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.09	4.91	-21.44	2	7	0	80	470.751	8	↓ MOL2 SDF SMILES Flexibase

23038680

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(4-bromo-2-chloro-phenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2-bromophenyl)acetamide 2-[[2-[(4-bromo-2-chloro-phenyl)…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.86	9.1	-52.06	3	5	1	63	490.603	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.86	6.84	-15.6	2	5	0	61	489.595	6	↓ MOL2 SDF SMILES Flexibase

23038681

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2-propoxyphenyl)acetamide 2-[[2-[(2-bromophenyl)amino]-2-o…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.33	8.99	-49.58	3	6	1	72	435.342	9	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.33	6.74	-17.61	2	6	0	71	434.334	9	↓ MOL2 SDF SMILES Flexibase

23038682

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-bromophenyl)-2-[[2-[(4-chloro-2,5-dimethoxy-phenyl)amino]-2-oxo-ethyl]-methyl-amino]acetamide N-(2-bromophenyl)-2-[[2-[(4-chlo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.09	7.15	-55.11	3	7	1	81	471.759	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.09	4.9	-18.87	2	7	0	80	470.751	8	↓ MOL2 SDF SMILES Flexibase

23038683

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2,5-diethoxyphenyl)acetamide 2-[[2-[(2-bromophenyl)amino]-2-o…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.24	8.42	-51.49	3	7	1	81	465.368	10	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.24	6.17	-21.03	2	7	0	80	464.36	10	↓ MOL2 SDF SMILES Flexibase

23038688

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: ethyl ethyl

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.41	10.69	-58.86	3	7	1	89	475.363	10	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.41	8.44	-22.69	2	7	0	88	474.355	10	↓ MOL2 SDF SMILES Flexibase

23038690

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-bromophenyl)-2-[methyl-[2-[methyl-(4-nitrophenyl)amino]-2-oxo-ethyl]amino]acetamide N-(2-bromophenyl)-2-[methyl-[2-[…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.28	10.3	-60.8	2	8	1	100	436.286	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.28	8.04	-21.4	1	8	0	98	435.278	7	↓ MOL2 SDF SMILES Flexibase

23038691

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-ethyl-N-(o-tolyl)acetamide 2-[[2-[(2-bromophenyl)amino]-2-o…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.10	11.41	-51.09	2	5	1	54	419.343	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.10	9.17	-17.79	1	5	0	53	418.335	7	↓ MOL2 SDF SMILES Flexibase

23038694

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(2-bromophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2-cyanoethyl)-N-(4-ethoxyphenyl)acetamide 2-[[2-[(2-bromophenyl)amino]-2-o…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.21	11.15	-63.11	2	7	1	87	474.379	10	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.21	8.89	-22.9	1	7	0	86	473.371	10	↓ MOL2 SDF SMILES Flexibase

23039037

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(2-chloro-4-fluoro-phenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2,3-dimethylphenyl)acetamide 2-[[2-[(2-chloro-4-fluoro-phenyl…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.26	9.31	-56.89	3	5	1	63	378.855	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.26	7.05	-19.89	2	5	0	61	377.847	6	↓ MOL2 SDF SMILES Flexibase

23039040

Analogs

21792395
21792399

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[2-[(2,3-dimethylphenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[4-(trifluoromethoxy)phenyl]prop (2R)-2-[[2-[(2,3-dimethylphenyl)…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.42	8.74	-56.59	3	6	1	72	424.443	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.42	6.54	-24.13	2	6	0	71	423.435	8	↓ MOL2 SDF SMILES Flexibase

23039041

Analogs

21792395
21792399

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-[(2,3-dimethylphenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-[4-(trifluoromethoxy)phenyl]prop (2S)-2-[[2-[(2,3-dimethylphenyl)…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.42	8.81	-56.9	3	6	1	72	424.443	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	4.42	6.62	-24.51	2	6	0	71	423.435	8	↓ MOL2 SDF SMILES Flexibase

57293422

Analogs

8169999

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl]-methyl-amino]-N-(2,6-dimethylphenyl)acetamide 2-[[2-(5-chloro-2-cyano-anilino)…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.91	7.36	-17.34	2	6	0	85	384.867	6	↓ MOL2 SDF SMILES Flexibase

58132835

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl]-methyl-amino]-N-(4-chlorophenyl)acetamide 2-[[2-(5-chloro-2-cyano-anilino)…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.72	6.37	-17.7	2	6	0	85	391.258	6	↓ MOL2 SDF SMILES Flexibase

58338540

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[[2-(2-ethylanilino)-2-oxo-ethyl]-methyl-amino]acetyl]amino]benzamide 2-[[2-[[2-(2-ethylanilino)-2-oxo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.32	5.97	-48.41	5	7	1	106	369.445	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.14	5.3	-41.93	4	7	0	112	368.437	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.14	3	-60.03	3	7	-1	111	367.429	8	↓ MOL2 SDF SMILES Flexibase

58339543

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[ethyl-[2-(4-methoxyanilino)-2-oxo-ethyl]amino]acetyl]amino]benzamide 2-[[2-[ethyl-[2-(4-methoxyanilin…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.89	4.24	-45.11	5	8	1	115	385.444	9	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.71	3.59	-47.35	4	8	0	121	384.436	9	↓ MOL2 SDF SMILES Flexibase

14245107

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[methyl-[2-(methyl-phenyl-amino)-2-oxo-ethyl]amino]acetamid N-[4-chloro-3-(trifluoromethyl)p…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.06	10.17	-58.05	2	5	1	54	414.835	7	↓ MOL2 SDF SMILES Flexibase

14245114

Analogs

3540337

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(2,5-dimethylphenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(4-ethoxyphenyl)acetamide 2-[[2-[(2,5-dimethylphenyl)amino…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.94	8.85	-55.06	3	6	1	72	370.473	8	↓ MOL2 SDF SMILES Flexibase

3403483

Analogs

3541160
16590209

Draw Identity 99% 90% 80% 70%

Popular Name: [2-keto-2-(p-phenetidino)ethyl]-[2-keto-2-(2,3,4-trifluoroanilino)ethyl]-methyl-ammonium [2-keto-2-(p-phenetidino)ethyl]-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.46	1.97	-59.08	3	6	1	71	396.389	8	↓ MOL2 SDF SMILES Flexibase

3403489

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [2-(4-carbamoylanilino)-2-keto-ethyl]-[2-keto-2-(o-toluidino)ethyl]-propyl-ammonium [2-(4-carbamoylanilino)-2-keto-e…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.78	6.14	-57.55	5	7	1	106	383.472	9	↓ MOL2 SDF SMILES Flexibase

3403769

Analogs

3541286

Draw Identity 99% 90% 80% 70%

Popular Name: [2-(4-chloroanilino)-2-keto-ethyl]-[2-(2,6-diethylanilino)-2-keto-ethyl]-methyl-ammonium [2-(4-chloroanilino)-2-keto-ethy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.16	0.9	-55.26	3	5	1	62	388.919	8	↓ MOL2 SDF SMILES Flexibase

3403795

Analogs

3403802

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S)-2-(2,3-dichloroanilino)-2-keto-1-methyl-ethyl]-[2-(2,6-dimethylanilino)-2-keto-ethyl]-methyl-a [(1S)-2-(2,3-dichloroanilino)-2-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.77	0.72	-47.88	3	5	1	62	409.337	6	↓ MOL2 SDF SMILES Flexibase

3403802

Analogs

3403795

Draw Identity 99% 90% 80% 70%

Popular Name: [(1R)-2-(2,3-dichloroanilino)-2-keto-1-methyl-ethyl]-[2-(2,6-dimethylanilino)-2-keto-ethyl]-methyl-a [(1R)-2-(2,3-dichloroanilino)-2-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.77	0.64	-42.47	3	5	1	62	409.337	6	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

ring.id = 6322
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 6322 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=6322&filter.purchasability=annotated

Embed Link to Results

<div id="zinc-link"></div>
<script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script>
<script type="text/javascript">
    window.zinc.embed('zinc-link', {
        "ring.id": "6322"        

    });
</script>

ZINC 12

User Information

Navigation

About

Search

Subsets

Help

Social

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations

Analogs

Activity (Go SEA)

Physical Representations