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ZINC Item

Suppliers, Protomers, & Similar Substances

1785890

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3,4-dimethylphenyl)-N-(4-fluorophenyl)-5-keto-7-propyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxami N'-(3,4-dimethylphenyl)-N-(4-flu…

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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	-0.87	-20.62	2	7	0	92	478.549	6	↓ MOL2 SDF SMILES Flexibase

1785896

Analogs

1320789

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-propyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 4-[[2-[(4-fluorophenyl)carbamoyl…

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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)	5.05	11.24	-20.9	2	9	0	119	522.558	9	↓ MOL2 SDF SMILES Flexibase

1785905

Analogs

1320831

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-5-keto-N'-(3-methoxyphenyl)-7-propyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(4-fluorophenyl)-5-keto-N'-(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	-1.4	-20.45	2	8	0	101	480.521	7	↓ MOL2 SDF SMILES Flexibase

1785907

Analogs

1320849
1320913

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-5-keto-N'-phenyl-7-propyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(4-fluorophenyl)-5-keto-N'-phe…

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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	-1.42	-20.4	2	7	0	92	450.495	6	↓ MOL2 SDF SMILES Flexibase

1785909

Analogs

1320852
1320940

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-ethylphenyl)-N-(4-fluorophenyl)-5-keto-7-propyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N'-(4-ethylphenyl)-N-(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)	5.42	-0.93	-20.2	2	7	0	92	478.549	7	↓ MOL2 SDF SMILES Flexibase

1785913

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-butylphenyl)-N-(4-fluorophenyl)-5-keto-7-propyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N'-(4-butylphenyl)-N-(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)	6.37	12.66	-20.01	2	7	0	93	506.603	9	↓ MOL2 SDF SMILES Flexibase

1785915

Analogs

1320838
1320843
1320873

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-chlorophenyl)-N-(4-fluorophenyl)-5-keto-7-propyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N'-(4-chlorophenyl)-N-(4-fluorop…

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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)	5.19	-1.56	-18.91	2	7	0	92	484.94	6	↓ MOL2 SDF SMILES Flexibase

1785917

Analogs

1320831

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2,5-dimethoxyphenyl)-N-(4-fluorophenyl)-5-keto-7-propyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxam N'-(2,5-dimethoxyphenyl)-N-(4-fl…

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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)	4.55	8.82	-24.6	2	9	0	111	510.547	8	↓ MOL2 SDF SMILES Flexibase

1785921

Analogs

1320847

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-propyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 3-[[2-[(4-fluorophenyl)carbamoyl…

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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)	4.65	10.3	-20.57	2	9	0	119	508.531	8	↓ MOL2 SDF SMILES Flexibase

1785925

Analogs

1320789

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-propyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 4-[[2-[(4-fluorophenyl)carbamoyl…

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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	10.32	-21.12	2	9	0	119	508.531	8	↓ MOL2 SDF SMILES Flexibase

1785926

Analogs

1320940

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3,4-dimethylphenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxami N'-(3,4-dimethylphenyl)-N-(4-flu…

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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)	4.26	-0.65	-22.02	2	7	0	92	450.495	4	↓ MOL2 SDF SMILES Flexibase

1785928

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 4-[[2-[(4-fluorophenyl)carbamoyl…

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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	11.32	-21.34	2	9	0	119	522.558	9	↓ MOL2 SDF SMILES Flexibase

1785929

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 4-[[2-[(4-fluorophenyl)carbamoyl…

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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)	4.48	10.54	-21.48	2	9	0	119	508.531	8	↓ MOL2 SDF SMILES Flexibase

1785931

Analogs

8717854

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 4-[[2-[(4-fluorophenyl)carbamoyl…

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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)	3.98	-0.52	-21.74	2	9	0	118	494.504	7	↓ MOL2 SDF SMILES Flexibase

1785933

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 3-[[2-[(4-fluorophenyl)carbamoyl…

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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)	4.46	10.52	-20.99	2	9	0	119	508.531	8	↓ MOL2 SDF SMILES Flexibase

1785937

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 3-[[2-[(4-fluorophenyl)carbamoyl…

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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)	4.32	10.43	-21.39	2	9	0	119	508.531	7	↓ MOL2 SDF SMILES Flexibase

1785938

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 3-[[2-[(4-fluorophenyl)carbamoyl…

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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)	3.95	-0.54	-21.16	2	9	0	118	494.504	7	↓ MOL2 SDF SMILES Flexibase

1785943

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-bromophenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N'-(4-bromophenyl)-N-(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)	4.24	8.76	-19.7	2	7	0	93	501.337	4	↓ MOL2 SDF SMILES Flexibase

1785944

Analogs

1320925
1320940

Draw Identity 99% 90% 80% 70%

Popular Name: N,N'-bis(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N,N'-bis(4-fluorophenyl)-5-keto-…

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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)	3.60	-0.9	-20.17	2	7	0	92	440.431	4	↓ MOL2 SDF SMILES Flexibase

1785946

Analogs

1320943

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-5-keto-N'-(4-methoxyphenyl)-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(4-fluorophenyl)-5-keto-N'-(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)	3.49	7.42	-21.45	2	8	0	102	452.467	5	↓ MOL2 SDF SMILES Flexibase

1785947

Analogs

1320831

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-5-keto-N'-(3-methoxyphenyl)-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(4-fluorophenyl)-5-keto-N'-(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)	3.46	-1.62	-21.35	2	8	0	101	452.467	5	↓ MOL2 SDF SMILES Flexibase

1785952

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-5-keto-N'-(2-methoxyphenyl)-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(4-fluorophenyl)-5-keto-N'-(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)	3.44	-1.56	-22.25	2	8	0	101	452.467	5	↓ MOL2 SDF SMILES Flexibase

1785953

Analogs

1320940

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-5-keto-7-methyl-N'-(p-tolyl)thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(4-fluorophenyl)-5-keto-7-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)	3.88	-1.31	-21.36	2	7	0	92	436.468	4	↓ MOL2 SDF SMILES Flexibase

1785955

Analogs

1320925
1320940

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-5-keto-7-methyl-N'-phenyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(4-fluorophenyl)-5-keto-7-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)	3.43	-1.64	-21.28	2	7	0	92	422.441	4	↓ MOL2 SDF SMILES Flexibase

1785956

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-ethylphenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N'-(2-ethylphenyl)-N-(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)	4.30	-0.99	-21.15	2	7	0	92	450.495	5	↓ MOL2 SDF SMILES Flexibase

1785958

Analogs

1320940

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2,4-dimethylphenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxami N'-(2,4-dimethylphenyl)-N-(4-flu…

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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)	4.26	9.51	-21.15	2	7	0	93	450.495	4	↓ MOL2 SDF SMILES Flexibase

1785959

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2,3-dimethylphenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxami N'-(2,3-dimethylphenyl)-N-(4-flu…

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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)	4.23	-0.92	-21.97	2	7	0	92	450.495	4	↓ MOL2 SDF SMILES Flexibase

1785961

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3,5-dimethylphenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxami N'-(3,5-dimethylphenyl)-N-(4-flu…

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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)	4.26	-0.61	-21.92	2	7	0	92	450.495	4	↓ MOL2 SDF SMILES Flexibase

1785964

Analogs

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Popular Name: N'-(3-chloro-4-methyl-phenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicar N'-(3-chloro-4-methyl-phenyl)-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)	4.49	-1.47	-19.18	2	7	0	92	470.913	4	↓ MOL2 SDF SMILES Flexibase

1785966

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-chloro-2-methyl-phenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicar N'-(4-chloro-2-methyl-phenyl)-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)	4.49	-1.3	-20	2	7	0	92	470.913	4	↓ MOL2 SDF SMILES Flexibase

1785970

Analogs

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Popular Name: N'-(4-butylphenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N'-(4-butylphenyl)-N-(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)	5.30	11.05	-24.21	2	7	0	93	478.549	7	↓ MOL2 SDF SMILES Flexibase

1785973

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2,5-dimethoxyphenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxam N'-(2,5-dimethoxyphenyl)-N-(4-fl…

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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)	3.47	-1.25	-25.64	2	9	0	111	482.493	6	↓ MOL2 SDF SMILES Flexibase

1785975

Analogs

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Popular Name: N-(4-fluorophenyl)-5-keto-7-methyl-N'-p-phenetyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(4-fluorophenyl)-5-keto-7-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)	3.86	-0.64	-21.06	2	8	0	101	466.494	6	↓ MOL2 SDF SMILES Flexibase

1785977

Analogs

1320842

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-5-keto-7-methyl-N'-o-phenetyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(4-fluorophenyl)-5-keto-7-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)	3.82	8.31	-21.93	2	8	0	102	466.494	6	↓ MOL2 SDF SMILES Flexibase

1785980

Analogs

1320941

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-chlorophenyl)-N-(4-fluorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N'-(3-chlorophenyl)-N-(4-fluorop…

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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)	4.09	-1.78	-21.94	2	7	0	92	456.886	4	↓ MOL2 SDF SMILES Flexibase

1785982

Analogs

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Popular Name: 3-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 3-[[2-[(4-fluorophenyl)carbamoyl…

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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)	3.58	-0.51	-21.51	2	9	0	118	480.477	6	↓ MOL2 SDF SMILES Flexibase

1785984

Analogs

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Popular Name: N-(4-fluorophenyl)-5-keto-7-methyl-N'-[3-(trifluoromethyl)phenyl]thiazolo[3,2-a]pyrimidine-2,3-dicar N-(4-fluorophenyl)-5-keto-7-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)	4.30	0.54	-18.79	2	7	0	92	490.438	5	↓ MOL2 SDF SMILES Flexibase

1785986

Analogs

1320888

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 4-[[2-[(4-fluorophenyl)carbamoyl…

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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)	3.60	-0.49	-21.84	2	9	0	118	480.477	6	↓ MOL2 SDF SMILES Flexibase

1785987

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[2-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-3-carbonyl]amino]benzoic 3-[[2-[(4-fluorophenyl)carbamoyl…

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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)	5.02	11.3	-20.81	2	9	0	119	522.558	9	↓ MOL2 SDF SMILES Flexibase

1786011

Analogs

1320932

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,5-dichlorophenyl)-5-keto-7-methyl-N'-(p-tolyl)thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N-(3,5-dichlorophenyl)-5-keto-7-…

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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)	5.00	-2.21	-19.86	2	7	0	92	487.368	4	↓ MOL2 SDF SMILES Flexibase

1786015

Analogs

1320871
1320947
1320948

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,5-dichlorophenyl)-N'-(3,5-dimethylphenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarbo N-(3,5-dichlorophenyl)-N'-(3,5-d…

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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)	5.38	-2.09	-20.26	2	7	0	92	501.395	4	↓ MOL2 SDF SMILES Flexibase

1786021

Analogs

1320838
1320843
1320873

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-chlorophenyl)-N-(3,5-dichlorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxami N'-(4-chlorophenyl)-N-(3,5-dichl…

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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	9.63	-18.61	2	7	0	93	507.786	4	↓ MOL2 SDF SMILES Flexibase

1786023

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-butylphenyl)-N-(4-chlorophenyl)-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide N'-(4-butylphenyl)-N-(4-chloroph…

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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)	5.81	11.5	-23.49	2	7	0	93	495.004	7	↓ MOL2 SDF SMILES Flexibase

1786024

Analogs

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Popular Name: 4-[[3-[(2,5-dimethylphenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]ben 4-[[3-[(2,5-dimethylphenyl)carba…

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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	-0.14	-23.6	2	9	0	119	518.595	8	↓ MOL2 SDF SMILES Flexibase

1786025

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[3-[(4-fluorophenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]benzoic 4-[[3-[(4-fluorophenyl)carbamoyl…

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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)	4.48	10.5	-23.69	2	9	0	119	508.531	8	↓ MOL2 SDF SMILES Flexibase

1786027

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[5-keto-3-[(4-methoxyphenyl)carbamoyl]-7-methyl-thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]benzoi 4-[[5-keto-3-[(4-methoxyphenyl)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)	4.37	9.73	-24.92	2	10	0	128	520.567	9	↓ MOL2 SDF SMILES Flexibase

1786028

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[5-keto-3-[(3-methoxyphenyl)carbamoyl]-7-methyl-thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]benzoi 4-[[5-keto-3-[(3-methoxyphenyl)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)	4.35	9.72	-24.87	2	10	0	128	520.567	9	↓ MOL2 SDF SMILES Flexibase

1786029

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[5-keto-3-[(2-methoxyphenyl)carbamoyl]-7-methyl-thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]benzoi 4-[[5-keto-3-[(2-methoxyphenyl)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)	4.33	9.68	-23.72	2	10	0	128	520.567	9	↓ MOL2 SDF SMILES Flexibase

1786030

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[5-keto-7-methyl-3-(p-tolylcarbamoyl)thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]benzoic-acid-prop 4-[[5-keto-7-methyl-3-(p-tolylca…

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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)	4.77	11.1	-24.91	2	9	0	119	504.568	8	↓ MOL2 SDF SMILES Flexibase

1786032

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[5-keto-7-methyl-3-(m-tolylcarbamoyl)thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]benzoic-acid-prop 4-[[5-keto-7-methyl-3-(m-tolylca…

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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)	4.74	11.1	-24.8	2	9	0	119	504.568	8	↓ MOL2 SDF SMILES Flexibase

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