ZINC 12

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ZINC Item

Suppliers, Protomers, & Similar Substances

38587933

Analogs

12417812

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3-chlorophenyl)-4-(4-fluorophenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(3-chlorophenyl)-4-(4-fluoroph…

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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)	5.23	7.25	-10.11	0	5	0	63	420.893	4	↓ MOL2 SDF SMILES Flexibase

38587950

Analogs

38587954

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,4-dichlorophenyl)-4-(4-fluorophenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(2,4-dichlorophenyl)-4-(4-fluo…

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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)	5.86	8.4	-10.07	0	5	0	63	455.338	4	↓ MOL2 SDF SMILES Flexibase

38587954

Analogs

38587950

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,4-dichlorophenyl)-4-(4-fluorophenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(2,4-dichlorophenyl)-4-(4-fluo…

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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)	6.10	8.99	-9.98	0	5	0	63	469.365	4	↓ MOL2 SDF SMILES Flexibase

38587977

Analogs

38587981

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-bromophenyl)-4-(4-fluorophenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(2-bromophenyl)-4-(4-fluorophe…

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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	8.16	-11.76	0	5	0	63	465.344	4	↓ MOL2 SDF SMILES Flexibase

38587981

Analogs

38587977

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-bromophenyl)-4-(4-fluorophenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(2-bromophenyl)-4-(4-fluorophe…

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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)	5.58	8.73	-11.63	0	5	0	63	479.371	4	↓ MOL2 SDF SMILES Flexibase

38588004

Analogs

38588008

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3-bromophenyl)-4-(4-fluorophenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(3-bromophenyl)-4-(4-fluorophe…

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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)	5.36	7.36	-10.02	0	5	0	63	465.344	4	↓ MOL2 SDF SMILES Flexibase

38588008

Analogs

38588004

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3-bromophenyl)-4-(4-fluorophenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(3-bromophenyl)-4-(4-fluorophe…

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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)	5.60	7.88	-10.56	0	5	0	63	479.371	4	↓ MOL2 SDF SMILES Flexibase

38588054

Analogs

38588056
38588071

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-fluorophenyl)sulfonyl-2-(2-methoxyphenyl)-5-(1-piperidyl)oxazole 4-(4-fluorophenyl)sulfonyl-2-(2-…

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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)	4.58	6.58	-13.58	0	6	0	73	416.474	5	↓ MOL2 SDF SMILES Flexibase

38588056

Analogs

38588054

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-fluorophenyl)sulfonyl-2-(2-methoxyphenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(4-fluorophenyl)sulfonyl-2-(2-…

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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	7.15	-13.45	0	6	0	73	430.501	5	↓ MOL2 SDF SMILES Flexibase

38588075

Analogs

38588078
38588094

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-fluorophenyl)sulfonyl-2-(3-methoxyphenyl)-5-(1-piperidyl)oxazole 4-(4-fluorophenyl)sulfonyl-2-(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)	4.61	6.05	-12.59	0	6	0	73	416.474	5	↓ MOL2 SDF SMILES Flexibase

38588078

Analogs

38588094
38588075

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-fluorophenyl)sulfonyl-2-(3-methoxyphenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(4-fluorophenyl)sulfonyl-2-(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)	4.85	6.57	-12.44	0	6	0	73	430.501	5	↓ MOL2 SDF SMILES Flexibase

38588097

Analogs

38588100
38588115

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-fluorophenyl)sulfonyl-2-(3-nitrophenyl)-5-(1-piperidyl)oxazole 4-(4-fluorophenyl)sulfonyl-2-(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)	4.51	6.84	-16.73	0	8	0	109	431.445	5	↓ MOL2 SDF SMILES Flexibase

38588100

Analogs

38588115
38588097

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-fluorophenyl)sulfonyl-5-(4-methyl-1-piperidyl)-2-(3-nitrophenyl)oxazole 4-(4-fluorophenyl)sulfonyl-5-(4-…

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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)	4.75	7.43	-16.62	0	8	0	109	445.472	5	↓ MOL2 SDF SMILES Flexibase

38588117

Analogs

38588121

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-tert-butylphenyl)-4-(4-fluorophenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(4-tert-butylphenyl)-4-(4-fluo…

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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)	6.28	9.06	-10.08	0	5	0	63	442.556	5	↓ MOL2 SDF SMILES Flexibase

38588121

Analogs

38588117

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-tert-butylphenyl)-4-(4-fluorophenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(4-tert-butylphenyl)-4-(4-fluo…

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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)	6.52	9.63	-9.88	0	5	0	63	456.583	5	↓ MOL2 SDF SMILES Flexibase

38588208

Analogs

38588211
39843904
39843907

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-bromophenyl)sulfonyl-2-(4-tert-butylphenyl)-5-(1-piperidyl)oxazole 4-(4-bromophenyl)sulfonyl-2-(4-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)	6.92	9.63	-9.74	0	5	0	63	503.462	5	↓ MOL2 SDF SMILES Flexibase

38588211

Analogs

39843956
39843962
38588208

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-bromophenyl)sulfonyl-2-(4-tert-butylphenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(4-bromophenyl)sulfonyl-2-(4-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)	7.17	10.19	-9.58	0	5	0	63	517.489	5	↓ MOL2 SDF SMILES Flexibase

38588224

Analogs

38588227

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-bromophenyl)sulfonyl-2-(3-chlorophenyl)-5-(1-piperidyl)oxazole 4-(4-bromophenyl)sulfonyl-2-(3-c…

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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)	5.87	7.8	-9.78	0	5	0	63	481.799	4	↓ MOL2 SDF SMILES Flexibase

38588227

Analogs

38588224

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-bromophenyl)sulfonyl-2-(3-chlorophenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(4-bromophenyl)sulfonyl-2-(3-c…

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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)	6.11	8.33	-10.28	0	5	0	63	495.826	4	↓ MOL2 SDF SMILES Flexibase

38588250

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-bromophenyl)sulfonyl-2-(2,4-dichlorophenyl)-5-(1-piperidyl)oxazole 4-(4-bromophenyl)sulfonyl-2-(2,4…

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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)	6.50	8.95	-9.78	0	5	0	63	516.244	4	↓ MOL2 SDF SMILES Flexibase

38588289

Analogs

20069234

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-bromophenyl)sulfonyl-2-(2-methoxyphenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(4-bromophenyl)sulfonyl-2-(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)	5.47	7.71	-13.12	0	6	0	73	491.407	5	↓ MOL2 SDF SMILES Flexibase

38588305

Analogs

38588309
38588328

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-bromophenyl)sulfonyl-2-(3-methoxyphenyl)-5-(1-piperidyl)oxazole 4-(4-bromophenyl)sulfonyl-2-(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)	5.25	6.6	-12.24	0	6	0	73	477.38	5	↓ MOL2 SDF SMILES Flexibase

38588309

Analogs

38588328
38588305

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-bromophenyl)sulfonyl-2-(3-methoxyphenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(4-bromophenyl)sulfonyl-2-(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)	5.49	7.12	-12.13	0	6	0	73	491.407	5	↓ MOL2 SDF SMILES Flexibase

38588363

Analogs

39859740
3158724

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,4-dichlorophenyl)-5-(4-methyl-1-piperidyl)-4-(p-tolylsulfonyl)oxazole 2-(2,4-dichlorophenyl)-5-(4-meth…

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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)	6.38	9.59	-11.3	0	5	0	63	465.402	4	↓ MOL2 SDF SMILES Flexibase

38588367

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(benzenesulfonyl)-2-(2-bromophenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(benzenesulfonyl)-2-(2-bromoph…

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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)	5.41	8.66	-13.47	0	5	0	63	461.381	4	↓ MOL2 SDF SMILES Flexibase

38588371

Analogs

39859746
20807037

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(benzenesulfonyl)-2-(3-bromophenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(benzenesulfonyl)-2-(3-bromoph…

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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)	5.44	7.81	-12.19	0	5	0	63	461.381	4	↓ MOL2 SDF SMILES Flexibase

38588376

Analogs

38588401
4539586
904469

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-methoxyphenyl)-5-(4-methyl-1-piperidyl)-4-(p-tolylsulfonyl)oxazole 2-(2-methoxyphenyl)-5-(4-methyl-…

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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	7.76	-15.18	0	6	0	73	426.538	5	↓ MOL2 SDF SMILES Flexibase

38588380

Analogs

730275

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-chlorophenyl)sulfonyl-2-(2-methoxyphenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(4-chlorophenyl)sulfonyl-2-(2-…

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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	7.6	-13.22	0	6	0	73	446.956	5	↓ MOL2 SDF SMILES Flexibase

38588395

Analogs

38588398
3066725

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(benzenesulfonyl)-5-(4-methyl-1-piperidyl)-2-(3-nitrophenyl)oxazole 4-(benzenesulfonyl)-5-(4-methyl-…

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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)	4.59	7.37	-18.12	0	8	0	109	427.482	5	↓ MOL2 SDF SMILES Flexibase

38588398

Analogs

2480324
8858703

Draw Identity 99% 90% 80% 70%

Popular Name: 5-(4-methyl-1-piperidyl)-2-(3-nitrophenyl)-4-(p-tolylsulfonyl)oxazole 5-(4-methyl-1-piperidyl)-2-(3-ni…

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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)	5.03	8.05	-17.91	0	8	0	109	441.509	5	↓ MOL2 SDF SMILES Flexibase

38588401

Analogs

38588406
38588376

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-ethylphenyl)sulfonyl-2-(2-methoxyphenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(4-ethylphenyl)sulfonyl-2-(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)	5.57	8.52	-14.77	0	6	0	73	440.565	6	↓ MOL2 SDF SMILES Flexibase

38588406

Analogs

38588425
904469
38588401

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-ethylphenyl)sulfonyl-2-(2-methoxyphenyl)-5-(1-piperidyl)oxazole 4-(4-ethylphenyl)sulfonyl-2-(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)	5.33	7.93	-15	0	6	0	73	426.538	6	↓ MOL2 SDF SMILES Flexibase

38588429

Analogs

38588434

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-ethylphenyl)sulfonyl-2-(2-fluorophenyl)-5-(1-piperidyl)oxazole 4-(4-ethylphenyl)sulfonyl-2-(2-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)	5.44	8.46	-15.35	0	5	0	63	414.502	5	↓ MOL2 SDF SMILES Flexibase

38588434

Analogs

38588429

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-ethylphenyl)sulfonyl-2-(2-fluorophenyl)-5-(4-methyl-1-piperidyl)oxazole 4-(4-ethylphenyl)sulfonyl-2-(2-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)	5.68	9.05	-15.15	0	5	0	63	428.529	5	↓ MOL2 SDF SMILES Flexibase

38589080

Analogs

38589088
38589318
38589344
38590022
38590057

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-methoxyphenyl)sulfonyl-2-phenyl-5-(1-piperidyl)oxazole 4-(4-methoxyphenyl)sulfonyl-2-ph…

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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)	4.47	5.95	-12.89	0	6	0	73	398.484	5	↓ MOL2 SDF SMILES Flexibase

38589088

Analogs

38589321
38589348
38590025
38590059
40513105

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-methoxyphenyl)sulfonyl-5-(4-methyl-1-piperidyl)-2-phenyl-oxazole 4-(4-methoxyphenyl)sulfonyl-5-(4…

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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	6.5	-12.21	0	6	0	73	412.511	5	↓ MOL2 SDF SMILES Flexibase

38589216

Analogs

38589219
38590066

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-fluorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(4-fluorophenyl)-4-(4-methoxyp…

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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)	4.63	6.01	-11.41	0	6	0	73	416.474	5	↓ MOL2 SDF SMILES Flexibase

38589219

Analogs

38590067
38589216

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-fluorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(4-fluorophenyl)-4-(4-methoxyp…

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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)	4.87	6.61	-10.77	0	6	0	73	430.501	5	↓ MOL2 SDF SMILES Flexibase

38589227

Analogs

38589231
38590073

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(2-chlorophenyl)-4-(4-methoxyp…

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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)	5.10	7.12	-14.28	0	6	0	73	432.929	5	↓ MOL2 SDF SMILES Flexibase

38589231

Analogs

38590075
38589227

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(2-chlorophenyl)-4-(4-methoxyp…

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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	7.71	-13.4	0	6	0	73	446.956	5	↓ MOL2 SDF SMILES Flexibase

38589241

Analogs

38589242
38590082

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(3-chlorophenyl)-4-(4-methoxyp…

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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)	5.12	6.46	-12.68	0	6	0	73	432.929	5	↓ MOL2 SDF SMILES Flexibase

38589242

Analogs

38590084
38589241

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(3-chlorophenyl)-4-(4-methoxyp…

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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)	5.36	7.01	-11.93	0	6	0	73	446.956	5	↓ MOL2 SDF SMILES Flexibase

38589250

Analogs

38589253
38590094

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(4-chlorophenyl)-4-(4-methoxyp…

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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	6.47	-11.17	0	6	0	73	432.929	5	↓ MOL2 SDF SMILES Flexibase

38589253

Analogs

38590097
38589250

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(4-chlorophenyl)-4-(4-methoxyp…

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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)	5.39	7.06	-10.49	0	6	0	73	446.956	5	↓ MOL2 SDF SMILES Flexibase

38589261

Analogs

38589263
38590210

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,4-dichlorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(2,4-dichlorophenyl)-4-(4-meth…

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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	7.63	-12.03	0	6	0	73	467.374	5	↓ MOL2 SDF SMILES Flexibase

38589263

Analogs

38590213
38589261

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,4-dichlorophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(2,4-dichlorophenyl)-4-(4-meth…

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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)	5.99	8.22	-11.25	0	6	0	73	481.401	5	↓ MOL2 SDF SMILES Flexibase

38589274

Analogs

38589277
38590107

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-bromophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(2-bromophenyl)-4-(4-methoxyph…

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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)	5.23	7.37	-13.91	0	6	0	73	477.38	5	↓ MOL2 SDF SMILES Flexibase

38589277

Analogs

38590110
38589274

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-bromophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(2-bromophenyl)-4-(4-methoxyph…

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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)	5.47	7.96	-13.07	0	6	0	73	491.407	5	↓ MOL2 SDF SMILES Flexibase

38589288

Analogs

38589292
38590119

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3-bromophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(1-piperidyl)oxazole 2-(3-bromophenyl)-4-(4-methoxyph…

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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)	5.25	6.57	-12.62	0	6	0	73	477.38	5	↓ MOL2 SDF SMILES Flexibase

38589292

Analogs

38590121
38589288

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3-bromophenyl)-4-(4-methoxyphenyl)sulfonyl-5-(4-methyl-1-piperidyl)oxazole 2-(3-bromophenyl)-4-(4-methoxyph…

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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	7.11	-11.87	0	6	0	73	491.407	5	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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Structural Results Found: (before additional filtering)

SQL Query Was

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