ZINC 12

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ZINC Item

Suppliers, Protomers, & Similar Substances

36129423

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-N-(2-hydroxyethyl)-1-propylsulfonyl-pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-N-(2-hydroxye…

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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)	0.07	2.45	-20.65	1	6	0	78	304.412	7	↓ MOL2 SDF SMILES Flexibase

36129424

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-N-(2-hydroxyethyl)-1-propylsulfonyl-pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-N-(2-hydroxye…

Find On: PubMed — Wikipedia — Google

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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)	0.07	2.39	-20.19	1	6	0	78	304.412	7	↓ MOL2 SDF SMILES Flexibase

36129474

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-1-(2,2-dimethylpropanoyl)-N-(2-hydroxyethyl)pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-1-(2,2-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)	0.84	4.08	-20.37	1	5	0	61	282.384	5	↓ MOL2 SDF SMILES Flexibase

36129475

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-1-(2,2-dimethylpropanoyl)-N-(2-hydroxyethyl)pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-1-(2,2-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)	0.84	4.62	-20.63	1	5	0	61	282.384	5	↓ MOL2 SDF SMILES Flexibase

36130352

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-N-(2-hydroxyethyl)-1-methylsulfonyl-pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-N-(2-hydroxye…

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Activity (Go SEA)

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)	-0.81	0.77	-20.87	1	6	0	78	276.358	5	↓ MOL2 SDF SMILES Flexibase

36130353

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-N-(2-hydroxyethyl)-1-methylsulfonyl-pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-N-(2-hydroxye…

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Activity (Go SEA)

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)	-0.81	0.42	-24.65	1	6	0	78	276.358	5	↓ MOL2 SDF SMILES Flexibase

36136795

Analogs

37814595
37814596
37821379
37821380
37824809

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-N-(2-hydroxyethyl)pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-N-(2-hydroxye…

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Activity (Go SEA)

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)	-0.43	1.19	-35.88	3	4	1	57	199.274	4	↓ MOL2 SDF SMILES Flexibase

36136798

Analogs

37814595
37814596
37821379
37821380
37824809

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-N-(2-hydroxyethyl)pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-N-(2-hydroxye…

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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)	-0.43	1.23	-35.83	3	4	1	57	199.274	4	↓ MOL2 SDF SMILES Flexibase

36136902

Analogs

37814643
37814644
37814645
37814646

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4S)-N-cyclopropyl-4-hydroxy-N-(2-hydroxyethyl)pyrrolidine-2-carboxamide (2S,4S)-N-cyclopropyl-4-hydroxy-…

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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)	-1.34	-2.01	-41.26	4	5	1	77	215.273	4	↓ MOL2 SDF SMILES Flexibase

36136905

Analogs

37814643
37814644
37814645
37814646

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4S)-N-cyclopropyl-4-hydroxy-N-(2-hydroxyethyl)pyrrolidine-2-carboxamide (2R,4S)-N-cyclopropyl-4-hydroxy-…

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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)	-1.34	-1.92	-38.51	4	5	1	77	215.273	4	↓ MOL2 SDF SMILES Flexibase

36136907

Analogs

37814643
37814644
37814645
37814646

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4R)-N-cyclopropyl-4-hydroxy-N-(2-hydroxyethyl)pyrrolidine-2-carboxamide (2S,4R)-N-cyclopropyl-4-hydroxy-…

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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)	-1.34	-1.94	-37.33	4	5	1	77	215.273	4	↓ MOL2 SDF SMILES Flexibase

36136910

Analogs

37814643
37814644
37814645
37814646

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4R)-N-cyclopropyl-4-hydroxy-N-(2-hydroxyethyl)pyrrolidine-2-carboxamide (2R,4R)-N-cyclopropyl-4-hydroxy-…

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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)	-1.34	-1.91	-40.74	4	5	1	77	215.273	4	↓ MOL2 SDF SMILES Flexibase

37080062

Analogs

37810327
37810328
37810329
20433836
20434388

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4S)-N-cyclopropyl-N-ethyl-4-hydroxy-pyrrolidine-2-carboxamide (2S,4S)-N-cyclopropyl-N-ethyl-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)	-0.33	0.77	-40.12	3	4	1	57	199.274	3	↓ MOL2 SDF SMILES Flexibase

37080063

Analogs

20433836
20434388
20434614

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4S)-N-cyclopropyl-N-ethyl-4-hydroxy-pyrrolidine-2-carboxamide (2R,4S)-N-cyclopropyl-N-ethyl-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)	-0.33	0.67	-37.3	3	4	1	57	199.274	3	↓ MOL2 SDF SMILES Flexibase

37080064

Analogs

20433836
20434388
20434614

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4R)-N-cyclopropyl-N-ethyl-4-hydroxy-pyrrolidine-2-carboxamide (2S,4R)-N-cyclopropyl-N-ethyl-4-…

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Activity (Go SEA)

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	0.8	-36.85	3	4	1	57	199.274	3	↓ MOL2 SDF SMILES Flexibase

37080065

Analogs

37807037
37807038
37807039
37807040
37814643

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4R)-N-cyclopropyl-N-ethyl-4-hydroxy-pyrrolidine-2-carboxamide (2R,4R)-N-cyclopropyl-N-ethyl-4-…

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Activity (Go SEA)

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	0.7	-39.38	3	4	1	57	199.274	3	↓ MOL2 SDF SMILES Flexibase

37080108

Analogs

37810279
37810280
45096495
45096496
45096695

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-N-ethyl-pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-N-ethyl-pyrro…

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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)	0.58	4.09	-36.29	2	3	1	37	183.275	3	↓ MOL2 SDF SMILES Flexibase

37080109

Analogs

37810279
37810280
45096495
45096496
45096695

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-N-ethyl-pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-N-ethyl-pyrro…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	0.58	4.09	-35.08	2	3	1	37	183.275	3	↓ MOL2 SDF SMILES Flexibase

37081182

Analogs

37807037
37807038
37807039
37807040
37810327

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4S)-N-cyclopropyl-4-hydroxy-N-methyl-pyrrolidine-2-carboxamide (2S,4S)-N-cyclopropyl-4-hydroxy-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	-0.71	-0.14	-40.99	3	4	1	57	185.247	2	↓ MOL2 SDF SMILES Flexibase

37081183

Analogs

37807037
37807038
37807039
37807040
37810327

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4S)-N-cyclopropyl-4-hydroxy-N-methyl-pyrrolidine-2-carboxamide (2R,4S)-N-cyclopropyl-4-hydroxy-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	-0.71	-0.06	-38.54	3	4	1	57	185.247	2	↓ MOL2 SDF SMILES Flexibase

37081184

Analogs

37807037
37807038
37807039
37807040
37810327

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4R)-N-cyclopropyl-4-hydroxy-N-methyl-pyrrolidine-2-carboxamide (2S,4R)-N-cyclopropyl-4-hydroxy-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	-0.71	-0.08	-37.15	3	4	1	57	185.247	2	↓ MOL2 SDF SMILES Flexibase

37081185

Analogs

37807037
37807038
37807039
37807040
37810327

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4R)-N-cyclopropyl-4-hydroxy-N-methyl-pyrrolidine-2-carboxamide (2R,4R)-N-cyclopropyl-4-hydroxy-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	-0.71	-0.03	-40.76	3	4	1	57	185.247	2	↓ MOL2 SDF SMILES Flexibase

37081226

Analogs

37810279
37810280
45096495
45096496
45096695

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Pyrrolidinecarboxamide, N-cyclopropyl-N-methyl-, (2S)- (9CI) 2-Pyrrolidinecarboxamide, N-cycl…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	0.20	3.23	-36.13	2	3	1	37	169.248	2	↓ MOL2 SDF SMILES Flexibase

37081227

Analogs

37810279
37810280
45096495
45096496
45096695

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Pyrrolidinecarboxamide, N-cyclopropyl-N-methyl-, (2R)- (9CI) 2-Pyrrolidinecarboxamide, N-cycl…

Find On: PubMed — Wikipedia — Google

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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)	0.20	3.23	-36.26	2	3	1	37	169.248	2	↓ MOL2 SDF SMILES Flexibase

37097381

Analogs

37807037
37807038
37807039
37807040
37810327

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4S)-N-cyclopropyl-4-hydroxy-N-propyl-pyrrolidine-2-carboxamide (2S,4S)-N-cyclopropyl-4-hydroxy-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	0.17	1.63	-40.29	3	4	1	57	213.301	4	↓ MOL2 SDF SMILES Flexibase

37097382

Analogs

37807037
37807038
37807039
37807040
37810327

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4S)-N-cyclopropyl-4-hydroxy-N-propyl-pyrrolidine-2-carboxamide (2R,4S)-N-cyclopropyl-4-hydroxy-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	0.17	1.61	-38.27	3	4	1	57	213.301	4	↓ MOL2 SDF SMILES Flexibase

37097383

Analogs

37807037
37807038
37807039
37807040
37810327

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4R)-N-cyclopropyl-4-hydroxy-N-propyl-pyrrolidine-2-carboxamide (2S,4R)-N-cyclopropyl-4-hydroxy-…

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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)	0.17	1.68	-36.58	3	4	1	57	213.301	4	↓ MOL2 SDF SMILES Flexibase

37097384

Analogs

37807037
37807038
37807039
37807040
37810327

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4R)-N-cyclopropyl-4-hydroxy-N-propyl-pyrrolidine-2-carboxamide (2R,4R)-N-cyclopropyl-4-hydroxy-…

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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)	0.17	1.57	-40.41	3	4	1	57	213.301	4	↓ MOL2 SDF SMILES Flexibase

37097426

Analogs

37810279
37810280
45096495
45096496
45096695

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-N-propyl-pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-N-propyl-pyrr…

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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)	1.08	5.03	-35.83	2	3	1	37	197.302	4	↓ MOL2 SDF SMILES Flexibase

37097427

Analogs

37810279
37810280
45096495
45096496
45096695

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-N-propyl-pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-N-propyl-pyrr…

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Activity (Go SEA)

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)	1.08	4.95	-36.07	2	3	1	37	197.302	4	↓ MOL2 SDF SMILES Flexibase

54714392

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-[(2R)-3-chloro-2-methyl-propanoyl]-N-cyclopropyl-pyrrolidine-2-carboxamide (2R)-1-[(2R)-3-chloro-2-methyl-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)	0.88	5.49	-14.26	1	4	0	49	258.749	4	↓ MOL2 SDF SMILES Flexibase

54714393

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-[(2S)-3-chloro-2-methyl-propanoyl]-N-cyclopropyl-pyrrolidine-2-carboxamide (2R)-1-[(2S)-3-chloro-2-methyl-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)	0.88	5.26	-13.87	1	4	0	49	258.749	4	↓ MOL2 SDF SMILES Flexibase

54714394

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[(2R)-3-chloro-2-methyl-propanoyl]-N-cyclopropyl-pyrrolidine-2-carboxamide (2S)-1-[(2R)-3-chloro-2-methyl-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)	0.88	5.75	-14.36	1	4	0	49	258.749	4	↓ MOL2 SDF SMILES Flexibase

54714395

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[(2S)-3-chloro-2-methyl-propanoyl]-N-cyclopropyl-pyrrolidine-2-carboxamide (2S)-1-[(2S)-3-chloro-2-methyl-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)	0.88	6.02	-14.29	1	4	0	49	258.749	4	↓ MOL2 SDF SMILES Flexibase

61294772

Analogs

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Popular Name: (2R)-N-cyclopropyl-1-[3-(ethylamino)propanoyl]pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-1-[3-(ethylam…

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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)	-0.39	4.66	-46.46	3	5	1	66	254.354	6	↓ MOL2 SDF SMILES Flexibase

61294774

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-1-[3-(ethylamino)propanoyl]pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-1-[3-(ethylam…

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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)	-0.39	4.92	-46.42	3	5	1	66	254.354	6	↓ MOL2 SDF SMILES Flexibase

61294778

Analogs

40923376
40923379

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-1-[2-(ethylamino)-2-methyl-propanoyl]pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-1-[2-(ethylam…

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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)	0.50	4.51	-41.89	3	5	1	66	268.381	5	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	0.50	4.06	-13.56	2	5	0	61	267.373	5	↓ MOL2 SDF SMILES Flexibase

61294781

Analogs

40923376
40923379

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-1-[2-(ethylamino)-2-methyl-propanoyl]pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-1-[2-(ethylam…

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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)	0.50	5.29	-47.27	3	5	1	66	268.381	5	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	0.50	4.81	-14.34	2	5	0	61	267.373	5	↓ MOL2 SDF SMILES Flexibase

61317127

Analogs

40923376
40923379

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-1-[2-methyl-2-(methylamino)propanoyl]pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-1-[2-methyl-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)	0.12	3.7	-43.9	3	5	1	66	254.354	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	0.12	3.58	-14.52	2	5	0	61	253.346	4	↓ MOL2 SDF SMILES Flexibase

61317130

Analogs

40923376
40923379

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-1-[2-methyl-2-(methylamino)propanoyl]pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-1-[2-methyl-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)	0.12	4.47	-49.79	3	5	1	66	254.354	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	0.12	4.28	-14.09	2	5	0	61	253.346	4	↓ MOL2 SDF SMILES Flexibase

61490337

Analogs

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Popular Name: (2R)-1-[(2S)-2-bromobutanoyl]-N-cyclopropyl-pyrrolidine-2-carboxamide (2R)-1-[(2S)-2-bromobutanoyl]-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)	1.13	5.83	-15.79	1	4	0	49	303.2	4	↓ MOL2 SDF SMILES Flexibase

61490338

Analogs

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Popular Name: (2R)-1-[(2R)-2-bromobutanoyl]-N-cyclopropyl-pyrrolidine-2-carboxamide (2R)-1-[(2R)-2-bromobutanoyl]-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)	1.13	5.82	-14.37	1	4	0	49	303.2	4	↓ MOL2 SDF SMILES Flexibase

61490339

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[(2S)-2-bromobutanoyl]-N-cyclopropyl-pyrrolidine-2-carboxamide (2S)-1-[(2S)-2-bromobutanoyl]-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)	1.13	6.11	-14.48	1	4	0	49	303.2	4	↓ MOL2 SDF SMILES Flexibase

61490340

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[(2R)-2-bromobutanoyl]-N-cyclopropyl-pyrrolidine-2-carboxamide (2S)-1-[(2R)-2-bromobutanoyl]-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)	1.13	6.09	-15.79	1	4	0	49	303.2	4	↓ MOL2 SDF SMILES Flexibase

70087546

Analogs

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Popular Name: (2R)-1-(4-amino-4-methyl-pentanoyl)-N-cyclopropyl-pyrrolidine-2-carboxamide (2R)-1-(4-amino-4-methyl-pentano…

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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)	0.29	3.7	-48.25	4	5	1	77	268.381	5	↓ MOL2 SDF SMILES Flexibase

70087547

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-(4-amino-4-methyl-pentanoyl)-N-cyclopropyl-pyrrolidine-2-carboxamide (2S)-1-(4-amino-4-methyl-pentano…

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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)	0.29	3.97	-48.25	4	5	1	77	268.381	5	↓ MOL2 SDF SMILES Flexibase

41073347

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[2-[(2R)-2-(cyclopropylcarbamoyl)pyrrolidin-1-yl]-2-oxo-ethoxy]acetic 2-[2-[(2R)-2-(cyclopropylcarbamo…

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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)	-1.25	5.17	-68.97	1	7	-1	99	269.277	6	↓ MOL2 SDF SMILES Flexibase

41073348

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[2-[(2S)-2-(cyclopropylcarbamoyl)pyrrolidin-1-yl]-2-oxo-ethoxy]acetic 2-[2-[(2S)-2-(cyclopropylcarbamo…

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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)	-1.25	5.2	-68.83	1	7	-1	99	269.277	6	↓ MOL2 SDF SMILES Flexibase

41229817

Analogs

41229819

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxamide (2R)-N-cyclopropyl-1-(2,2,2-trif…

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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)	0.45	3.27	-13.42	1	4	0	49	250.22	3	↓ MOL2 SDF SMILES Flexibase

41229819

Analogs

41229817

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxamide (2S)-N-cyclopropyl-1-(2,2,2-trif…

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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)	0.45	4.43	-14.66	1	4	0	49	250.22	3	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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