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

41636738

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-bromo-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 7-bromo-1-[[(5S)-2-oxooxazolidin…

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)	1.14	2.27	-20.06	1	6	0	77	325.118	2	↓ MOL2 SDF SMILES Flexibase

41636740

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-bromo-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 7-bromo-1-[[(5R)-2-oxooxazolidin…

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)	1.14	2.33	-14.96	1	6	0	77	325.118	2	↓ MOL2 SDF SMILES Flexibase

42074715

Analogs

2479145
4501771

Draw Identity 99% 90% 80% 70%

Popular Name: 5,7-dimethyl-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5,7-dimethyl-1-[[(5S)-2-oxooxazo…

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)	1.18	3.06	-17.39	1	6	0	77	274.276	2	↓ MOL2 SDF SMILES Flexibase

42074718

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5,7-dimethyl-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5,7-dimethyl-1-[[(5R)-2-oxooxazo…

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)	1.18	2.91	-24.79	1	6	0	77	274.276	2	↓ MOL2 SDF SMILES Flexibase

42076515

Analogs

2479145

Draw Identity 99% 90% 80% 70%

Popular Name: 6,7-dimethyl-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 6,7-dimethyl-1-[[(5S)-2-oxooxazo…

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)	1.18	2.78	-24.8	1	6	0	77	274.276	2	↓ MOL2 SDF SMILES Flexibase

42076518

Analogs

2479145

Draw Identity 99% 90% 80% 70%

Popular Name: 6,7-dimethyl-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 6,7-dimethyl-1-[[(5R)-2-oxooxazo…

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)	1.18	2.93	-17.15	1	6	0	77	274.276	2	↓ MOL2 SDF SMILES Flexibase

42076899

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-methoxy-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 6-methoxy-1-[[(5S)-2-oxooxazolid…

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)	0.41	1.24	-24.12	1	7	0	87	276.248	3	↓ MOL2 SDF SMILES Flexibase

42076903

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-methoxy-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 6-methoxy-1-[[(5R)-2-oxooxazolid…

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)	0.41	1.24	-17.35	1	7	0	87	276.248	3	↓ MOL2 SDF SMILES Flexibase

42077345

Analogs

2479145

Draw Identity 99% 90% 80% 70%

Popular Name: 6-chloro-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 6-chloro-1-[[(5S)-2-oxooxazolidi…

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)	1.03	2.44	-22.71	1	6	0	77	280.667	2	↓ MOL2 SDF SMILES Flexibase

42077348

Analogs

2479145

Draw Identity 99% 90% 80% 70%

Popular Name: 6-chloro-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 6-chloro-1-[[(5R)-2-oxooxazolidi…

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)	1.03	2.44	-15.59	1	6	0	77	280.667	2	↓ MOL2 SDF SMILES Flexibase

42079157

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-bromo-5-fluoro-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 7-bromo-5-fluoro-1-[[(5S)-2-oxoo…

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)	0.28	2.33	-17.94	1	6	0	77	343.108	2	↓ MOL2 SDF SMILES Flexibase

42079160

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-bromo-5-fluoro-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 7-bromo-5-fluoro-1-[[(5R)-2-oxoo…

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)	0.28	2.39	-13.23	1	6	0	77	343.108	2	↓ MOL2 SDF SMILES Flexibase

42101185

Analogs

2479145

Draw Identity 99% 90% 80% 70%

Popular Name: 4,6-dimethyl-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4,6-dimethyl-1-[[(5S)-2-oxooxazo…

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)	1.18	3.23	-25.46	1	6	0	77	274.276	2	↓ MOL2 SDF SMILES Flexibase

42101187

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4,6-dimethyl-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4,6-dimethyl-1-[[(5R)-2-oxooxazo…

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)	1.18	3.23	-16.69	1	6	0	77	274.276	2	↓ MOL2 SDF SMILES Flexibase

42102711

Analogs

9306539
9306538
13623714

Draw Identity 99% 90% 80% 70%

Popular Name: 5-methoxy-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5-methoxy-1-[[(5S)-2-oxooxazolid…

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)	0.41	1.22	-27.71	1	7	0	87	276.248	3	↓ MOL2 SDF SMILES Flexibase

42102713

Analogs

9306539
9306538
13623714

Draw Identity 99% 90% 80% 70%

Popular Name: 5-methoxy-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5-methoxy-1-[[(5R)-2-oxooxazolid…

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)	0.41	1.22	-17.92	1	7	0	87	276.248	3	↓ MOL2 SDF SMILES Flexibase

42105320

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-ethyl-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5-ethyl-1-[[(5S)-2-oxooxazolidin…

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)	1.27	3.36	-26.09	1	6	0	77	274.276	3	↓ MOL2 SDF SMILES Flexibase

42105323

Analogs

2479145
4501771

Draw Identity 99% 90% 80% 70%

Popular Name: 5-ethyl-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5-ethyl-1-[[(5R)-2-oxooxazolidin…

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)	1.27	3.36	-16.71	1	6	0	77	274.276	3	↓ MOL2 SDF SMILES Flexibase

42108190

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4,7-dimethyl-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4,7-dimethyl-1-[[(5S)-2-oxooxazo…

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)	1.18	3.05	-17.67	1	6	0	77	274.276	2	↓ MOL2 SDF SMILES Flexibase

42108193

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4,7-dimethyl-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4,7-dimethyl-1-[[(5R)-2-oxooxazo…

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)	1.18	2.91	-25.2	1	6	0	77	274.276	2	↓ MOL2 SDF SMILES Flexibase

42111415

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-chloro-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 7-chloro-1-[[(5S)-2-oxooxazolidi…

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)	1.01	2.22	-20.48	1	6	0	77	280.667	2	↓ MOL2 SDF SMILES Flexibase

42111418

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-chloro-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 7-chloro-1-[[(5R)-2-oxooxazolidi…

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)	1.01	2.24	-15.21	1	6	0	77	280.667	2	↓ MOL2 SDF SMILES Flexibase

42114163

Analogs

19864431

Draw Identity 99% 90% 80% 70%

Popular Name: 5,7-difluoro-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5,7-difluoro-1-[[(5S)-2-oxooxazo…

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)	-0.36	1.96	-19.21	1	6	0	77	282.202	2	↓ MOL2 SDF SMILES Flexibase

42114165

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5,7-difluoro-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5,7-difluoro-1-[[(5R)-2-oxooxazo…

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)	-0.36	1.98	-14.3	1	6	0	77	282.202	2	↓ MOL2 SDF SMILES Flexibase

42116599

Analogs

19864431

Draw Identity 99% 90% 80% 70%

Popular Name: 7-fluoro-5-methyl-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 7-fluoro-5-methyl-1-[[(5S)-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)	0.90	2.56	-20.23	1	6	0	77	278.239	2	↓ MOL2 SDF SMILES Flexibase

42116602

Analogs

19864431

Draw Identity 99% 90% 80% 70%

Popular Name: 7-fluoro-5-methyl-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 7-fluoro-5-methyl-1-[[(5R)-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)	0.90	2.58	-15.38	1	6	0	77	278.239	2	↓ MOL2 SDF SMILES Flexibase

42118009

Analogs

2746316
6809364

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-7-methyl-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5-bromo-7-methyl-1-[[(5S)-2-oxoo…

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)	1.54	2.86	-24	1	6	0	77	339.145	2	↓ MOL2 SDF SMILES Flexibase

42118011

Analogs

2746316
6809364

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-7-methyl-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5-bromo-7-methyl-1-[[(5R)-2-oxoo…

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)	1.54	3.01	-16.65	1	6	0	77	339.145	2	↓ MOL2 SDF SMILES Flexibase

42118973

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-7-fluoro-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4-chloro-7-fluoro-1-[[(5S)-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)	1.13	2.4	-22.13	1	6	0	77	298.657	2	↓ MOL2 SDF SMILES Flexibase

42118974

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-7-fluoro-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4-chloro-7-fluoro-1-[[(5R)-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)	1.13	2.41	-16.1	1	6	0	77	298.657	2	↓ MOL2 SDF SMILES Flexibase

42134901

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4,6-difluoro-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4,6-difluoro-1-[[(5S)-2-oxooxazo…

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)	0.61	2.06	-25.75	1	6	0	77	282.202	2	↓ MOL2 SDF SMILES Flexibase

42134902

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4,6-difluoro-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4,6-difluoro-1-[[(5R)-2-oxooxazo…

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)	0.61	2.06	-16.94	1	6	0	77	282.202	2	↓ MOL2 SDF SMILES Flexibase

42135419

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-6-fluoro-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5-bromo-6-fluoro-1-[[(5S)-2-oxoo…

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)	1.26	2.58	-23	1	6	0	77	343.108	2	↓ MOL2 SDF SMILES Flexibase

42135420

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-6-fluoro-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 5-bromo-6-fluoro-1-[[(5R)-2-oxoo…

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)	1.26	2.58	-15.58	1	6	0	77	343.108	2	↓ MOL2 SDF SMILES Flexibase

42136185

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-1-[[(5S)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4-chloro-1-[[(5S)-2-oxooxazolidi…

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)	1.01	2.43	-29.29	1	6	0	77	280.667	2	↓ MOL2 SDF SMILES Flexibase

42136186

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-1-[[(5R)-2-oxooxazolidin-5-yl]methyl]indoline-2,3-dione 4-chloro-1-[[(5R)-2-oxooxazolidi…

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)	1.01	2.43	-18.64	1	6	0	77	280.667	2	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

ring.id = 558141
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 = 558141 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=558141&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": "558141"        

    });
</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