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ZINC Item

Suppliers, Protomers, & Similar Substances

2787711

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-chlorobenzyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide N-(3-chlorobenzyl)pyrazolo[1,5-a…

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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	-1.3	-13.75	1	5	0	59	286.722	3	↓ MOL2 SDF SMILES Flexibase

2788074

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-chlorobenzyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide N-(4-chlorobenzyl)pyrazolo[1,5-a…

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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)	2.08	-1.3	-13.37	1	5	0	59	286.722	3	↓ MOL2 SDF SMILES Flexibase

2788256

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorobenzyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide N-(4-fluorobenzyl)pyrazolo[1,5-a…

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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)	1.57	-0.42	-13.91	1	5	0	59	270.267	3	↓ MOL2 SDF SMILES Flexibase

2791964

Analogs

2791965

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(4-tert-butylphenyl)ethyl]-3-chloro-pyrazolo[1,5-a]pyrimidine-2-carboxamide N-[(1S)-1-(4-tert-butylphenyl)et…

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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)	4.28	0.62	-15.12	1	5	0	59	356.857	4	↓ MOL2 SDF SMILES Flexibase

2791965

Analogs

2791964

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1-(4-tert-butylphenyl)ethyl]-3-chloro-pyrazolo[1,5-a]pyrimidine-2-carboxamide N-[(1R)-1-(4-tert-butylphenyl)et…

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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)	4.28	0.62	-15.12	1	5	0	59	356.857	4	↓ MOL2 SDF SMILES Flexibase

2791971

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(6-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]methyl]benzoate 4-[[(6-bromopyrazolo[1,5-a]pyrim…

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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)	2.27	-2.37	-54.15	1	7	-1	99	374.174	4	↓ MOL2 SDF SMILES Flexibase

2792410

Analogs

2792411
2792412
2792413

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1R)-1-[4-[(1R)-1-methylpropyl]phenyl]ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1R)-1-[4-[(1R)-1-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)	4.42	0.43	-15.01	1	5	0	59	356.857	5	↓ MOL2 SDF SMILES Flexibase

2792411

Analogs

2792412
2792413
2792410

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1R)-1-[4-[(1S)-1-methylpropyl]phenyl]ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1R)-1-[4-[(1S)-1-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)	4.42	0.43	-15.02	1	5	0	59	356.857	5	↓ MOL2 SDF SMILES Flexibase

2792412

Analogs

2792413
2792410

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1S)-1-[4-[(1R)-1-methylpropyl]phenyl]ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1S)-1-[4-[(1R)-1-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)	4.42	0.43	-15.05	1	5	0	59	356.857	5	↓ MOL2 SDF SMILES Flexibase

2792413

Analogs

2792410

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1S)-1-[4-[(1S)-1-methylpropyl]phenyl]ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1S)-1-[4-[(1S)-1-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)	4.42	0.43	-15.02	1	5	0	59	356.857	5	↓ MOL2 SDF SMILES Flexibase

2792470

Analogs

2792471

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1S)-1-p-cumenylpropyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1S)-1-p-cumenylprop…

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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)	3.68	0.23	-14.61	1	5	0	59	356.857	5	↓ MOL2 SDF SMILES Flexibase

2792471

Analogs

2792470

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1R)-1-p-cumenylpropyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1R)-1-p-cumenylprop…

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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)	3.68	0.23	-14.58	1	5	0	59	356.857	5	↓ MOL2 SDF SMILES Flexibase

2792634

Analogs

2792635

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-N-[(1R)-1-p-cumenylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1R)-1-p-cumenylethyl…

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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)	4.43	8.78	-8.28	1	5	0	59	387.281	4	↓ MOL2 SDF SMILES Flexibase

2792635

Analogs

2792634

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-N-[(1S)-1-p-cumenylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1S)-1-p-cumenylethyl…

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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)	4.43	8.78	-8.31	1	5	0	59	387.281	4	↓ MOL2 SDF SMILES Flexibase

2792684

Analogs

2792685

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1R)-1-(2,4-dimethyl…

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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)	3.39	0.12	-15.43	1	5	0	59	328.803	3	↓ MOL2 SDF SMILES Flexibase

2792685

Analogs

2792684

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1S)-1-(2,4-dimethyl…

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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)	3.39	0.19	-15.5	1	5	0	59	328.803	3	↓ MOL2 SDF SMILES Flexibase

2793344

Analogs

2793345

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1R)-1-(2,4-dimethylp…

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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)	3.74	-0.53	-8.63	1	5	0	59	373.254	3	↓ MOL2 SDF SMILES Flexibase

2793345

Analogs

2793344

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1S)-1-(2,4-dimethylp…

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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)	3.74	-0.47	-8.72	1	5	0	59	373.254	3	↓ MOL2 SDF SMILES Flexibase

2793361

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-(4-fluorobenzyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-(4-fluorobenzyl)pyraz…

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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)	2.17	-0.55	-15.42	1	5	0	59	304.712	3	↓ MOL2 SDF SMILES Flexibase

2793421

Analogs

2793422

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1S)-1-(p-tolyl)propyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1S)-1-(p-tolyl)prop…

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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)	2.62	-0.25	-14.89	1	5	0	59	328.803	4	↓ MOL2 SDF SMILES Flexibase

2793422

Analogs

2793421

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1R)-1-(p-tolyl)propyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1R)-1-(p-tolyl)prop…

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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)	2.62	-0.24	-14.88	1	5	0	59	328.803	4	↓ MOL2 SDF SMILES Flexibase

2793551

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-3-chloro-pyrazolo[1,5-a]pyrimidine-2-carboxamide N-benzyl-3-chloro-pyrazolo[1,5-a…

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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)	2.01	-1.29	-15.13	1	5	0	59	286.722	3	↓ MOL2 SDF SMILES Flexibase

2793655

Analogs

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Popular Name: 6-bromo-N-(4-fluorobenzyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-(4-fluorobenzyl)pyrazo…

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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)	2.52	-1.21	-8.97	1	5	0	59	349.163	3	↓ MOL2 SDF SMILES Flexibase

2793680

Analogs

2793681
2793951
2793952

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-N-[(1S)-1-(p-tolyl)propyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1S)-1-(p-tolyl)propy…

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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)	2.97	-0.9	-8.18	1	5	0	59	373.254	4	↓ MOL2 SDF SMILES Flexibase

2793681

Analogs

2793951
2793952
2793680

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-N-[(1R)-1-(p-tolyl)propyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1R)-1-(p-tolyl)propy…

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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)	2.97	-0.9	-8.15	1	5	0	59	373.254	4	↓ MOL2 SDF SMILES Flexibase

2793778

Analogs

2793779

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1S)-1-phenylpropyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1S)-1-phenylpropyl]…

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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)	2.17	-0.57	-14.92	1	5	0	59	314.776	4	↓ MOL2 SDF SMILES Flexibase

2793779

Analogs

2793778

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1R)-1-phenylpropyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1R)-1-phenylpropyl]…

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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)	2.17	-0.56	-14.92	1	5	0	59	314.776	4	↓ MOL2 SDF SMILES Flexibase

2793851

Analogs

2793852

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1S)-1-(2,5-dimethox…

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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)	2.61	-0.35	-18.07	1	7	0	77	360.801	5	↓ MOL2 SDF SMILES Flexibase

2793852

Analogs

2793851

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1R)-1-(2,5-dimethox…

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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)	2.61	-0.36	-18.05	1	7	0	77	360.801	5	↓ MOL2 SDF SMILES Flexibase

2793951

Analogs

2793952
2793680

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-N-[(1S)-1-phenylpropyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1S)-1-phenylpropyl]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)	2.52	-1.22	-8.19	1	5	0	59	359.227	4	↓ MOL2 SDF SMILES Flexibase

2793952

Analogs

2793680

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-N-[(1R)-1-phenylpropyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1R)-1-phenylpropyl]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)	2.52	-1.22	-8.2	1	5	0	59	359.227	4	↓ MOL2 SDF SMILES Flexibase

2794170

Analogs

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Popular Name: 6-bromo-N-(2-chlorobenzyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-(2-chlorobenzyl)pyrazo…

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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)	2.99	-2.12	-9.29	1	5	0	59	365.618	3	↓ MOL2 SDF SMILES Flexibase

2794368

Analogs

2794369

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Popular Name: 3-chloro-N-[(1S)-1-(4-methoxyphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1S)-1-(4-methoxyphe…

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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)	2.63	-0.51	-16.66	1	6	0	68	330.775	4	↓ MOL2 SDF SMILES Flexibase

2794369

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2794368

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Popular Name: 3-chloro-N-[(1R)-1-(4-methoxyphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 3-chloro-N-[(1R)-1-(4-methoxyphe…

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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)	2.63	-0.51	-16.66	1	6	0	68	330.775	4	↓ MOL2 SDF SMILES Flexibase

2794506

Analogs

2794507

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Popular Name: 6-bromo-N-[(1S)-1-(4-methoxyphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1S)-1-(4-methoxyphen…

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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)	2.98	-1.17	-9.95	1	6	0	68	375.226	4	↓ MOL2 SDF SMILES Flexibase

2794507

Analogs

2794506

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-N-[(1R)-1-(4-methoxyphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide 6-bromo-N-[(1R)-1-(4-methoxyphen…

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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)	2.98	-1.16	-9.92	1	6	0	68	375.226	4	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

ring.id = 235966
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 235966 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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