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ZINC Item

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10504966

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dichlorophenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,5-dichlorophenyl)-2-[6-(3-n…

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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)	5.04	0.06	-18.56	1	7	0	100	435.292	6	↓ MOL2 SDF SMILES Flexibase

10504969

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,5-dichlorophenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-acetamide N-(3,5-dichlorophenyl)-2-[6-(3-n…

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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)	5.04	-0.11	-18.97	1	7	0	100	435.292	6	↓ MOL2 SDF SMILES Flexibase

10504971

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dichlorophenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,3-dichlorophenyl)-2-[6-(3-n…

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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	0.07	-18.56	1	7	0	100	435.292	6	↓ MOL2 SDF SMILES Flexibase

10504973

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluoro-3-nitro-phenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-acetamide N-(4-fluoro-3-nitro-phenyl)-2-[6…

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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)	3.81	9.83	-28.18	1	10	0	147	429.389	7	↓ MOL2 SDF SMILES Flexibase

10504983

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-N-(4-isopropylphenyl)-acetamide 2-[6-(4-ethoxyphenyl)pyridazin-3…

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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)	5.77	0.51	-13.11	1	5	0	64	407.539	8	↓ MOL2 SDF SMILES Flexibase

10504985

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-chlorophenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2-chlorophenyl)-2-[6-(4-ethox…

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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)	4.88	-0.27	-12.12	1	5	0	64	399.903	7	↓ MOL2 SDF SMILES Flexibase

10504987

Analogs

36716377
36716524
36716542

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]-acetamide 2-[6-(4-ethoxyphenyl)pyridazin-3…

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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)	5.13	2	-14.74	1	6	0	73	463.481	9	↓ MOL2 SDF SMILES Flexibase

10504988

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-[2-chloro-5-(trifluoromethyl)p…

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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)	5.75	1.89	-12.7	1	5	0	64	467.9	8	↓ MOL2 SDF SMILES Flexibase

10504990

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]-acetamide 2-[6-(4-ethoxyphenyl)pyridazin-3…

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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)	5.22	1.23	-12.81	1	6	0	73	449.454	9	↓ MOL2 SDF SMILES Flexibase

10504996

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dichlorophenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,5-dichlorophenyl)-2-[6-(4-e…

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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)	5.54	-0.43	-11.92	1	5	0	64	434.348	7	↓ MOL2 SDF SMILES Flexibase

10504998

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,5-dichlorophenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(3,5-dichlorophenyl)-2-[6-(4-e…

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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)	5.54	-0.59	-12.53	1	5	0	64	434.348	7	↓ MOL2 SDF SMILES Flexibase

10505000

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dichlorophenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,3-dichlorophenyl)-2-[6-(4-e…

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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)	5.51	-0.42	-11.59	1	5	0	64	434.348	7	↓ MOL2 SDF SMILES Flexibase

10505002

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-N-(4-fluoro-3-nitro-phenyl)-acetamide 2-[6-(4-ethoxyphenyl)pyridazin-3…

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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)	4.30	0.87	-22.14	1	8	0	109	428.445	8	↓ MOL2 SDF SMILES Flexibase

10505009

Analogs

36716341
36716401
10132317

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-isopropylphenyl)-2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-acetamide N-(4-isopropylphenyl)-2-[6-(p-to…

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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)	5.78	0.79	-12.01	1	4	0	54	377.513	6	↓ MOL2 SDF SMILES Flexibase

10505011

Analogs

36716343
36716407
36716411
36716549
7596079

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-chlorophenyl)-2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-acetamide N-(2-chlorophenyl)-2-[6-(p-tolyl…

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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)	4.90	0.01	-11.04	1	4	0	54	369.877	5	↓ MOL2 SDF SMILES Flexibase

10505013

Analogs

36716344
36716364
36716524
36716542
10132363

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-acetamide N-[2-methoxy-5-(trifluoromethyl)…

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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)	5.15	2.28	-13.69	1	5	0	64	433.455	7	↓ MOL2 SDF SMILES Flexibase

10505015

Analogs

36716330
36716345
10132320

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-acetamide N-[2-chloro-5-(trifluoromethyl)p…

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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)	5.77	2.18	-11.61	1	4	0	54	437.874	6	↓ MOL2 SDF SMILES Flexibase

10505017

Analogs

36716346
10132321

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]-acetamide 2-[6-(p-tolyl)pyridazin-3-yl]sul…

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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)	5.24	1.51	-11.75	1	5	0	64	419.428	7	↓ MOL2 SDF SMILES Flexibase

10505023

Analogs

36716349
10132322

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dichlorophenyl)-2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,5-dichlorophenyl)-2-[6-(p-t…

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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)	5.55	-0.15	-10.88	1	4	0	54	404.322	5	↓ MOL2 SDF SMILES Flexibase

10505026

Analogs

36716350
10132323

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,5-dichlorophenyl)-2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-acetamide N-(3,5-dichlorophenyl)-2-[6-(p-t…

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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)	5.55	-0.3	-11.47	1	4	0	54	404.322	5	↓ MOL2 SDF SMILES Flexibase

10505028

Analogs

36716351
10132324

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dichlorophenyl)-2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,3-dichlorophenyl)-2-[6-(p-t…

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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)	5.53	-0.13	-10.59	1	4	0	54	404.322	5	↓ MOL2 SDF SMILES Flexibase

10505034

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-isopropylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(4-isopropylphenyl)-2-[6-(2-me…

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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)	5.34	0.76	-14.55	1	5	0	64	393.512	7	↓ MOL2 SDF SMILES Flexibase

10505036

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-butylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(4-butylphenyl)-2-[6-(2-methox…

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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)	5.69	0.68	-14.5	1	5	0	64	407.539	9	↓ MOL2 SDF SMILES Flexibase

10505039

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]-acetamide 2-[6-(2-methoxyphenyl)pyridazin-…

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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)	4.71	2.27	-16.04	1	6	0	73	449.454	8	↓ MOL2 SDF SMILES Flexibase

10505040

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-[2-chloro-5-(trifluoromethyl)p…

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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)	5.33	2.16	-14.12	1	5	0	64	453.873	7	↓ MOL2 SDF SMILES Flexibase

10505042

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]-acetamide 2-[6-(2-methoxyphenyl)pyridazin-…

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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)	4.80	1.48	-14.15	1	6	0	73	435.427	8	↓ MOL2 SDF SMILES Flexibase

10505048

Analogs

36634879

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dichlorophenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,5-dichlorophenyl)-2-[6-(2-m…

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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)	5.11	-0.16	-13.4	1	5	0	64	420.321	6	↓ MOL2 SDF SMILES Flexibase

10505050

Analogs

36634879

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,5-dichlorophenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(3,5-dichlorophenyl)-2-[6-(2-m…

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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)	5.11	-0.33	-13.76	1	5	0	64	420.321	6	↓ MOL2 SDF SMILES Flexibase

10505051

Analogs

36634879

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dichlorophenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,3-dichlorophenyl)-2-[6-(2-m…

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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)	5.09	-0.15	-13.14	1	5	0	64	420.321	6	↓ MOL2 SDF SMILES Flexibase

10505059

Analogs

36716407
36716411
36716549

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-chlorophenyl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2-chlorophenyl)-2-[6-(4-ethyl…

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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)	5.37	0.17	-10.78	1	4	0	54	383.904	6	↓ MOL2 SDF SMILES Flexibase

10505061

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]-acetamide 2-[6-(4-ethylphenyl)pyridazin-3-…

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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)	5.62	2.46	-13.38	1	5	0	64	447.482	8	↓ MOL2 SDF SMILES Flexibase

10505067

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanyl-N-(4-fluoro-3-nitro-phenyl)-acetamide 2-[6-(4-ethylphenyl)pyridazin-3-…

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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)	4.79	1.31	-20.88	1	7	0	100	412.446	7	↓ MOL2 SDF SMILES Flexibase

10505078

Analogs

36716421
36716425

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(4-bromophenyl)pyridazin-3-yl]sulfanyl-N-(2-chlorophenyl)-acetamide 2-[6-(4-bromophenyl)pyridazin-3-…

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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)	5.26	-1.07	-10.68	1	4	0	54	434.746	5	↓ MOL2 SDF SMILES Flexibase

10505082

Analogs

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Popular Name: 2-[6-(4-bromophenyl)pyridazin-3-yl]sulfanyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]-acetamide 2-[6-(4-bromophenyl)pyridazin-3-…

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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)	5.51	1.2	-13.3	1	5	0	64	498.324	7	↓ MOL2 SDF SMILES Flexibase

10505085

Analogs

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Popular Name: 2-[6-(4-bromophenyl)pyridazin-3-yl]sulfanyl-N-(2-nitrophenyl)-acetamide 2-[6-(4-bromophenyl)pyridazin-3-…

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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)	4.54	-0.19	-13.75	1	7	0	100	445.298	6	↓ MOL2 SDF SMILES Flexibase

10505096

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(4-bromophenyl)pyridazin-3-yl]sulfanyl-N-(4-fluoro-3-nitro-phenyl)-acetamide 2-[6-(4-bromophenyl)pyridazin-3-…

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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)	4.68	0.08	-20.86	1	7	0	100	463.288	6	↓ MOL2 SDF SMILES Flexibase

10505108

Analogs

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Popular Name: 2-[6-(4-fluorophenyl)pyridazin-3-yl]sulfanyl-N-(4-isopropylphenyl)-acetamide 2-[6-(4-fluorophenyl)pyridazin-3…

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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)	5.50	1.21	-12.23	1	4	0	54	381.476	6	↓ MOL2 SDF SMILES Flexibase

10505111

Analogs

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Popular Name: N-(4-butylphenyl)-2-[6-(4-fluorophenyl)pyridazin-3-yl]sulfanyl-acetamide N-(4-butylphenyl)-2-[6-(4-fluoro…

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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)	5.85	1.13	-12.19	1	4	0	54	395.503	8	↓ MOL2 SDF SMILES Flexibase

10505115

Analogs

36716542

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(4-fluorophenyl)pyridazin-3-yl]sulfanyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]-acetamide 2-[6-(4-fluorophenyl)pyridazin-3…

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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	2.7	-13.83	1	5	0	64	437.418	7	↓ MOL2 SDF SMILES Flexibase

10505118

Analogs

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Popular Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(4-fluorophenyl)pyridazin-3-yl]sulfanyl-acetamide N-[2-chloro-5-(trifluoromethyl)p…

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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)	5.49	2.59	-11.79	1	4	0	54	441.837	6	↓ MOL2 SDF SMILES Flexibase

10505122

Analogs

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Popular Name: 2-[6-(4-fluorophenyl)pyridazin-3-yl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]-acetamide 2-[6-(4-fluorophenyl)pyridazin-3…

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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)	4.95	1.93	-12.01	1	5	0	64	423.391	7	↓ MOL2 SDF SMILES Flexibase

10505133

Analogs

36716407
36716411
36716549

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Popular Name: N-(2,5-dichlorophenyl)-2-[6-(4-fluorophenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,5-dichlorophenyl)-2-[6-(4-f…

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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)	5.27	0.27	-11.04	1	4	0	54	408.285	5	↓ MOL2 SDF SMILES Flexibase

10505137

Analogs

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Popular Name: N-(3,5-dichlorophenyl)-2-[6-(4-fluorophenyl)pyridazin-3-yl]sulfanyl-acetamide N-(3,5-dichlorophenyl)-2-[6-(4-f…

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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)	5.27	0.11	-11.7	1	4	0	54	408.285	5	↓ MOL2 SDF SMILES Flexibase

10505140

Analogs

36716411
36716549

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dichlorophenyl)-2-[6-(4-fluorophenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,3-dichlorophenyl)-2-[6-(4-f…

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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)	5.24	0.28	-10.78	1	4	0	54	408.285	5	↓ MOL2 SDF SMILES Flexibase

10505161

Analogs

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Popular Name: N-(4-isopropylphenyl)-2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(4-isopropylphenyl)-2-[6-(3-me…

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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)	5.37	0.49	-14.69	1	5	0	64	393.512	7	↓ MOL2 SDF SMILES Flexibase

10505165

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-butylphenyl)-2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(4-butylphenyl)-2-[6-(3-methox…

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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)	5.72	0.41	-14.68	1	5	0	64	407.539	9	↓ MOL2 SDF SMILES Flexibase

10505168

Analogs

36716439
36716542

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]-acetamide 2-[6-(3-methoxyphenyl)pyridazin-…

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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)	4.73	2	-16.22	1	6	0	73	449.454	8	↓ MOL2 SDF SMILES Flexibase

10505173

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-[2-chloro-5-(trifluoromethyl)p…

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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)	5.35	1.88	-14.39	1	5	0	64	453.873	7	↓ MOL2 SDF SMILES Flexibase

10505177

Analogs

36716405
36716456
36716489
36716545

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]-acetamide 2-[6-(3-methoxyphenyl)pyridazin-…

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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)	4.82	1.21	-14.36	1	6	0	73	435.427	8	↓ MOL2 SDF SMILES Flexibase

10505190

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dichlorophenyl)-2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide N-(2,5-dichlorophenyl)-2-[6-(3-m…

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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)	5.14	-0.44	-13.65	1	5	0	64	420.321	6	↓ MOL2 SDF SMILES Flexibase

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Structural Results Found: (before additional filtering)

SQL Query Was

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