ZINC 12

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ZINC Item

Suppliers, Protomers, & Similar Substances

62658671

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,3R)-3-methylcyclohexyl]thiazole-4-carboxamide N-[(1S,3R)-3-methylcyclohexyl]th…

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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)	2.21	3.83	-8.44	1	3	0	42	224.329	2	↓ MOL2 SDF SMILES Flexibase

62658675

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,3S)-3-methylcyclohexyl]thiazole-4-carboxamide N-[(1S,3S)-3-methylcyclohexyl]th…

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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)	2.21	4.24	-8.21	1	3	0	42	224.329	2	↓ MOL2 SDF SMILES Flexibase

62658679

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3R)-3-methylcyclohexyl]thiazole-4-carboxamide N-[(1R,3R)-3-methylcyclohexyl]th…

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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)	2.21	4.24	-8.24	1	3	0	42	224.329	2	↓ MOL2 SDF SMILES Flexibase

62658682

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3S)-3-methylcyclohexyl]thiazole-4-carboxamide N-[(1R,3S)-3-methylcyclohexyl]th…

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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)	2.21	3.83	-8.41	1	3	0	42	224.329	2	↓ MOL2 SDF SMILES Flexibase

62659431

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: ethyl 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)	1.84	5.17	-12.41	1	5	0	68	282.365	5	↓ MOL2 SDF SMILES Flexibase

62660195

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(1-cyanocyclohexyl)-N-methyl-thiazole-4-carboxamide N-(1-cyanocyclohexyl)-N-methyl-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)	2.31	5.32	-14.54	0	4	0	57	249.339	2	↓ MOL2 SDF SMILES Flexibase

62660466

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3S)-3-hydroxycyclohexyl]thiazole-4-carboxamide N-[(1R,3S)-3-hydroxycyclohexyl]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)	0.82	-0.12	-9.64	2	4	0	62	226.301	2	↓ MOL2 SDF SMILES Flexibase

62660470

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,3S)-3-hydroxycyclohexyl]thiazole-4-carboxamide N-[(1S,3S)-3-hydroxycyclohexyl]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)	0.82	0.03	-11.74	2	4	0	62	226.301	2	↓ MOL2 SDF SMILES Flexibase

62660473

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3R)-3-hydroxycyclohexyl]thiazole-4-carboxamide N-[(1R,3R)-3-hydroxycyclohexyl]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)	0.82	0.29	-9.42	2	4	0	62	226.301	2	↓ MOL2 SDF SMILES Flexibase

62660474

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,3R)-3-hydroxycyclohexyl]thiazole-4-carboxamide N-[(1S,3R)-3-hydroxycyclohexyl]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)	0.82	-0.12	-9.64	2	4	0	62	226.301	2	↓ MOL2 SDF SMILES Flexibase

62660595

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-carbamoylcyclohexyl)thiazole-4-carboxamide N-(4-carbamoylcyclohexyl)thiazol…

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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)	0.33	0.29	-16.12	3	5	0	85	253.327	3	↓ MOL2 SDF SMILES Flexibase

62660598

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3S)-3-(2,2,2-trifluoroethoxy)cyclohexyl]thiazole-4-carboxamide N-[(1R,3S)-3-(2,2,2-trifluoroeth…

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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)	2.36	3.65	-10.3	1	4	0	51	308.325	5	↓ MOL2 SDF SMILES Flexibase

62660601

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,3S)-3-(2,2,2-trifluoroethoxy)cyclohexyl]thiazole-4-carboxamide N-[(1S,3S)-3-(2,2,2-trifluoroeth…

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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)	2.36	4.07	-10.15	1	4	0	51	308.325	5	↓ MOL2 SDF SMILES Flexibase

62660603

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3R)-3-(2,2,2-trifluoroethoxy)cyclohexyl]thiazole-4-carboxamide N-[(1R,3R)-3-(2,2,2-trifluoroeth…

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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)	2.36	4.07	-10.15	1	4	0	51	308.325	5	↓ MOL2 SDF SMILES Flexibase

62660605

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,3R)-3-(2,2,2-trifluoroethoxy)cyclohexyl]thiazole-4-carboxamide N-[(1S,3R)-3-(2,2,2-trifluoroeth…

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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)	2.36	3.65	-10.29	1	4	0	51	308.325	5	↓ MOL2 SDF SMILES Flexibase

62660609

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-(1,1-dimethylpropyl)cyclohexyl]thiazole-4-carboxamide N-[4-(1,1-dimethylpropyl)cyclohe…

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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)	3.64	6.11	-8.02	1	3	0	42	280.437	4	↓ MOL2 SDF SMILES Flexibase

62660638

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2S)-2-tert-butylcyclohexyl]thiazole-4-carboxamide N-[(1S,2S)-2-tert-butylcyclohexy…

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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)	3.77	6.56	-7.85	1	3	0	42	266.41	3	↓ MOL2 SDF SMILES Flexibase

62660642

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R)-2-tert-butylcyclohexyl]thiazole-4-carboxamide N-[(1S,2R)-2-tert-butylcyclohexy…

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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)	3.77	6.19	-8.02	1	3	0	42	266.41	3	↓ MOL2 SDF SMILES Flexibase

62660643

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S)-2-tert-butylcyclohexyl]thiazole-4-carboxamide N-[(1R,2S)-2-tert-butylcyclohexy…

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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)	3.77	6.17	-8	1	3	0	42	266.41	3	↓ MOL2 SDF SMILES Flexibase

62660645

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R)-2-tert-butylcyclohexyl]thiazole-4-carboxamide N-[(1R,2R)-2-tert-butylcyclohexy…

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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)	3.77	6.57	-7.87	1	3	0	42	266.41	3	↓ MOL2 SDF SMILES Flexibase

62661071

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R)-2-ethylcyclohexyl]thiazole-4-carboxamide N-[(1S,2R)-2-ethylcyclohexyl]thi…

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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)	2.95	5.1	-8.19	1	3	0	42	238.356	3	↓ MOL2 SDF SMILES Flexibase

62661075

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2S)-2-ethylcyclohexyl]thiazole-4-carboxamide N-[(1S,2S)-2-ethylcyclohexyl]thi…

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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)	2.95	4.73	-8.34	1	3	0	42	238.356	3	↓ MOL2 SDF SMILES Flexibase

62661078

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R)-2-ethylcyclohexyl]thiazole-4-carboxamide N-[(1R,2R)-2-ethylcyclohexyl]thi…

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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)	2.95	4.73	-8.33	1	3	0	42	238.356	3	↓ MOL2 SDF SMILES Flexibase

62661082

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S)-2-ethylcyclohexyl]thiazole-4-carboxamide N-[(1R,2S)-2-ethylcyclohexyl]thi…

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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)	2.95	5.1	-8.21	1	3	0	42	238.356	3	↓ MOL2 SDF SMILES Flexibase

62661090

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R,5R)-2-isopropyl-5-methyl-cyclohexyl]thiazole-4-carboxamide N-[(1R,2R,5R)-2-isopropyl-5-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)	3.96	6.4	-8.08	1	3	0	42	266.41	3	↓ MOL2 SDF SMILES Flexibase

62661092

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]thiazole-4-carboxamide N-[(1R,2R,5S)-2-isopropyl-5-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)	3.96	6.16	-8.11	1	3	0	42	266.41	3	↓ MOL2 SDF SMILES Flexibase

62661095

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl]thiazole-4-carboxamide N-[(1R,2S,5R)-2-isopropyl-5-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)	3.96	5.7	-8.34	1	3	0	42	266.41	3	↓ MOL2 SDF SMILES Flexibase

62661099

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S,5S)-2-isopropyl-5-methyl-cyclohexyl]thiazole-4-carboxamide N-[(1R,2S,5S)-2-isopropyl-5-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)	3.96	5.47	-8.22	1	3	0	42	266.41	3	↓ MOL2 SDF SMILES Flexibase

62661375

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]thiazole-4-carboxamide N-[(1R,3S)-3-(trifluoromethyl)cy…

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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)	2.76	4.15	-8.63	1	3	0	42	278.299	3	↓ MOL2 SDF SMILES Flexibase

62661378

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,3S)-3-(trifluoromethyl)cyclohexyl]thiazole-4-carboxamide N-[(1S,3S)-3-(trifluoromethyl)cy…

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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)	2.76	4.54	-8.38	1	3	0	42	278.299	3	↓ MOL2 SDF SMILES Flexibase

62661381

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3R)-3-(trifluoromethyl)cyclohexyl]thiazole-4-carboxamide N-[(1R,3R)-3-(trifluoromethyl)cy…

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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)	2.76	4.54	-8.38	1	3	0	42	278.299	3	↓ MOL2 SDF SMILES Flexibase

62661384

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,3R)-3-(trifluoromethyl)cyclohexyl]thiazole-4-carboxamide N-[(1S,3R)-3-(trifluoromethyl)cy…

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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)	2.76	4.15	-8.63	1	3	0	42	278.299	3	↓ MOL2 SDF SMILES Flexibase

62661509

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-(trifluoromethyl)cyclohexyl]thiazole-4-carboxamide N-[4-(trifluoromethyl)cyclohexyl…

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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)	2.53	4.57	-9.37	1	3	0	42	278.299	3	↓ MOL2 SDF SMILES Flexibase

62661518

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S)-2-(trifluoromethyl)cyclohexyl]thiazole-4-carboxamide N-[(1R,2S)-2-(trifluoromethyl)cy…

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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)	3.00	5.09	-9.84	1	3	0	42	278.299	3	↓ MOL2 SDF SMILES Flexibase

62661521

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2S)-2-(trifluoromethyl)cyclohexyl]thiazole-4-carboxamide N-[(1S,2S)-2-(trifluoromethyl)cy…

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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)	3.00	4.66	-9.76	1	3	0	42	278.299	3	↓ MOL2 SDF SMILES Flexibase

62661524

Analogs

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Popular Name: N-[(1R,2R)-2-(trifluoromethyl)cyclohexyl]thiazole-4-carboxamide N-[(1R,2R)-2-(trifluoromethyl)cy…

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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)	3.00	4.66	-9.76	1	3	0	42	278.299	3	↓ MOL2 SDF SMILES Flexibase

62661527

Analogs

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Popular Name: N-[(1S,2R)-2-(trifluoromethyl)cyclohexyl]thiazole-4-carboxamide N-[(1S,2R)-2-(trifluoromethyl)cy…

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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)	3.00	5.09	-9.84	1	3	0	42	278.299	3	↓ MOL2 SDF SMILES Flexibase

62662879

Analogs

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Popular Name: N-(4-ethylcyclohexyl)-N-methyl-thiazole-4-carboxamide N-(4-ethylcyclohexyl)-N-methyl-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)	2.91	6.91	-8.97	0	3	0	33	252.383	3	↓ MOL2 SDF SMILES Flexibase

62663318

Analogs

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Popular Name: N-methyl-N-[(1S,3R)-3-methylcyclohexyl]thiazole-4-carboxamide N-methyl-N-[(1S,3R)-3-methylcycl…

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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)	2.46	6.26	-9.07	0	3	0	33	238.356	2	↓ MOL2 SDF SMILES Flexibase

62663319

Analogs

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Popular Name: N-methyl-N-[(1S,3S)-3-methylcyclohexyl]thiazole-4-carboxamide N-methyl-N-[(1S,3S)-3-methylcycl…

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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)	2.46	6.3	-8.65	0	3	0	33	238.356	2	↓ MOL2 SDF SMILES Flexibase

62663321

Analogs

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Popular Name: N-methyl-N-[(1R,3R)-3-methylcyclohexyl]thiazole-4-carboxamide N-methyl-N-[(1R,3R)-3-methylcycl…

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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)	2.46	6.29	-8.79	0	3	0	33	238.356	2	↓ MOL2 SDF SMILES Flexibase

62663322

Analogs

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Popular Name: N-methyl-N-[(1R,3S)-3-methylcyclohexyl]thiazole-4-carboxamide N-methyl-N-[(1R,3S)-3-methylcycl…

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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)	2.46	6.26	-9.12	0	3	0	33	238.356	2	↓ MOL2 SDF SMILES Flexibase

62663349

Analogs

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Popular Name: N-(4-ethylcyclohexyl)thiazole-4-carboxamide N-(4-ethylcyclohexyl)thiazole-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)	2.66	4.89	-8.24	1	3	0	42	238.356	3	↓ MOL2 SDF SMILES Flexibase

62663396

Analogs

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Popular Name: N-(4-propylcyclohexyl)thiazole-4-carboxamide N-(4-propylcyclohexyl)thiazole-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)	3.22	5.23	-8.41	1	3	0	42	252.383	4	↓ MOL2 SDF SMILES Flexibase

62663583

Analogs

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Popular Name: N-(1-methylcyclohexyl)thiazole-4-carboxamide N-(1-methylcyclohexyl)thiazole-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)	2.65	4.15	-7.87	1	3	0	42	224.329	2	↓ MOL2 SDF SMILES Flexibase

70114867

Analogs

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Popular Name: 2-amino-N-[(1S,2R,4R)-2,4-dimethylcyclohexyl]thiazole-4-carboxamide 2-amino-N-[(1S,2R,4R)-2,4-dimeth…

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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)	2.06	4.57	-7.35	3	4	0	68	253.371	2	↓ MOL2 SDF SMILES Flexibase

70114868

Analogs

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Popular Name: 2-amino-N-[(1S,2R,4S)-2,4-dimethylcyclohexyl]thiazole-4-carboxamide 2-amino-N-[(1S,2R,4S)-2,4-dimeth…

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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)	2.06	3.76	-7.63	3	4	0	68	253.371	2	↓ MOL2 SDF SMILES Flexibase

70114869

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-amino-N-[(1R,2R,4R)-2,4-dimethylcyclohexyl]thiazole-4-carboxamide 2-amino-N-[(1R,2R,4R)-2,4-dimeth…

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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)	2.06	4.17	-7.52	3	4	0	68	253.371	2	↓ MOL2 SDF SMILES Flexibase

70114870

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-amino-N-[(1R,2R,4S)-2,4-dimethylcyclohexyl]thiazole-4-carboxamide 2-amino-N-[(1R,2R,4S)-2,4-dimeth…

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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)	2.06	3.94	-7.55	3	4	0	68	253.371	2	↓ MOL2 SDF SMILES Flexibase

70115545

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R,4R)-2,4-dimethylcyclohexyl]thiazole-4-carboxamide N-[(1S,2R,4R)-2,4-dimethylcycloh…

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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)	2.45	5.07	-8.18	1	3	0	42	238.356	2	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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