ZINC 12

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ZINC Item

Suppliers, Protomers, & Similar Substances

53306979

Analogs

39544418
39544420

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(8-ethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-acetam 2-(8-ethyl-2,4-dioxo-1,3-diazasp…

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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)	3.08	8.61	-15.38	1	6	0	70	389.471	5	↓ MOL2 SDF SMILES Flexibase

53306981

Analogs

39544418
39544420

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(8-ethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]-N-methyl-acetam 2-(8-ethyl-2,4-dioxo-1,3-diazasp…

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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)	3.08	9.29	-14.12	1	6	0	70	389.471	5	↓ MOL2 SDF SMILES Flexibase

36329596

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-2-[(5S,9R)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]deca N-[(4-tert-butylphenyl)methyl]-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)	4.27	11.83	-14.35	1	6	0	70	427.589	5	↓ MOL2 SDF SMILES Flexibase

36329597

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-2-[(5S,9S)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]deca N-[(4-tert-butylphenyl)methyl]-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)	4.27	11.11	-14.63	1	6	0	70	427.589	5	↓ MOL2 SDF SMILES Flexibase

36329598

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-2-[(5R,9R)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]deca N-[(4-tert-butylphenyl)methyl]-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)	4.27	11.1	-15.14	1	6	0	70	427.589	5	↓ MOL2 SDF SMILES Flexibase

36329599

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-2-[(5R,9S)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]deca N-[(4-tert-butylphenyl)methyl]-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)	4.27	11.83	-14.22	1	6	0	70	427.589	5	↓ MOL2 SDF SMILES Flexibase

12854819

Analogs

12854823
12854828
12854834
39543441
39543443

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-N-ethyl-2-[(5R,9S)-7,7,9-trimethyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]acetamide N-benzyl-N-ethyl-2-[(5R,9S)-7,7,…

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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)	2.94	10.41	-14.01	1	6	0	70	385.508	5	↓ MOL2 SDF SMILES Flexibase

12854823

Analogs

12854828
12854834
39543441
39543443
39543445

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-N-ethyl-2-[(5S,9S)-7,7,9-trimethyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]acetamide N-benzyl-N-ethyl-2-[(5S,9S)-7,7,…

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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)	2.94	9.64	-15.09	1	6	0	70	385.508	5	↓ MOL2 SDF SMILES Flexibase

12854828

Analogs

12854834
39543441
39543443
39543445
39543447

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-N-ethyl-2-[(5R,9R)-7,7,9-trimethyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]acetamide N-benzyl-N-ethyl-2-[(5R,9R)-7,7,…

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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)	2.94	9.64	-13.81	1	6	0	70	385.508	5	↓ MOL2 SDF SMILES Flexibase

12854834

Analogs

39543441
39543443
39543445
39543447
41095015

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-N-ethyl-2-[(5S,9R)-7,7,9-trimethyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]acetamide N-benzyl-N-ethyl-2-[(5S,9R)-7,7,…

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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)	2.94	10.41	-13.83	1	6	0	70	385.508	5	↓ MOL2 SDF SMILES Flexibase

22745037

Analogs

14268254
14268255
14268256
14268257

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-2-[(5R,6S)-6-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]-N-propyl-acetamide N-benzyl-2-[(5R,6S)-6-methyl-1,3…

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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)	3.02	9.81	-14.88	1	6	0	70	371.481	6	↓ MOL2 SDF SMILES Flexibase

22745041

Analogs

14268254
14268255
14268256
14268257

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-2-[(5S,6S)-6-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]-N-propyl-acetamide N-benzyl-2-[(5S,6S)-6-methyl-1,3…

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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)	3.02	9.25	-16.57	1	6	0	70	371.481	6	↓ MOL2 SDF SMILES Flexibase

22745045

Analogs

14268254
14268255
14268256
14268257

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-2-[(5R,6R)-6-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]-N-propyl-acetamide N-benzyl-2-[(5R,6R)-6-methyl-1,3…

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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)	3.02	9.25	-16.71	1	6	0	70	371.481	6	↓ MOL2 SDF SMILES Flexibase

22745049

Analogs

14268254
14268255
14268256
14268257

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-2-[(5S,6R)-6-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]-N-propyl-acetamide N-benzyl-2-[(5S,6R)-6-methyl-1,3…

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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)	3.02	9.8	-14.86	1	6	0	70	371.481	6	↓ MOL2 SDF SMILES Flexibase

22745065

Analogs

39544460
39570279
45672893
45672895

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-2-[8-(1,1-dimethylpropyl)-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]-N-propyl-acetamide N-benzyl-2-[8-(1,1-dimethylpropy…

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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)	4.21	11.56	-14.84	1	6	0	70	427.589	8	↓ MOL2 SDF SMILES Flexibase

22746197

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2-fluorophenyl)methyl]-N-methyl-2-[(5R,9R)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3- N-[(2-fluorophenyl)methyl]-N-met…

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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)	2.68	8.67	-13.11	1	6	0	70	389.471	4	↓ MOL2 SDF SMILES Flexibase

22746202

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2-fluorophenyl)methyl]-N-methyl-2-[(5R,9S)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3- N-[(2-fluorophenyl)methyl]-N-met…

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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)	2.68	9.39	-12.12	1	6	0	70	389.471	4	↓ MOL2 SDF SMILES Flexibase

22746206

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2-fluorophenyl)methyl]-N-methyl-2-[(5S,9R)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3- N-[(2-fluorophenyl)methyl]-N-met…

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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)	2.68	9.39	-12.26	1	6	0	70	389.471	4	↓ MOL2 SDF SMILES Flexibase

22746210

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2-fluorophenyl)methyl]-N-methyl-2-[(5S,9S)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3- N-[(2-fluorophenyl)methyl]-N-met…

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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)	2.68	8.67	-12.64	1	6	0	70	389.471	4	↓ MOL2 SDF SMILES Flexibase

36877222

Analogs

39544458
39570277
22967772
32911226

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2-bromophenyl)methyl]-N-methyl-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide N-[(2-bromophenyl)methyl]-N-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)	2.43	9.2	-14.16	1	6	0	70	422.323	4	↓ MOL2 SDF SMILES Flexibase

36877389

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-allyloxyphenyl)methyl]-N-methyl-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide N-[(4-allyloxyphenyl)methyl]-N-m…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.37	8.86	-16.38	1	7	0	79	399.491	7	↓ MOL2 SDF SMILES Flexibase

36877405

Analogs

21912633

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2,3-dichlorophenyl)methyl]-N-methyl-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamid N-[(2,3-dichlorophenyl)methyl]-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)	2.93	9.58	-14.45	1	6	0	70	412.317	4	↓ MOL2 SDF SMILES Flexibase

22994008

Analogs

8313771

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(8-tert-butyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-[(4-tert-butylphenyl)methyl]-N-methyl-ace 2-(8-tert-butyl-1,3-dioxo-2,4-di…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.71	11.41	-16.64	1	6	0	70	441.616	6	↓ MOL2 SDF SMILES Flexibase

22994151

Analogs

22181832
14261228
14268254
14268255
14268256

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-bromophenyl)methyl]-2-(8-tert-butyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-methyl-acetamid N-[(4-bromophenyl)methyl]-2-(8-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)	3.81	9.77	-16.55	1	6	0	70	464.404	5	↓ MOL2 SDF SMILES Flexibase

23013681

Analogs

8272921

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-2-(8-tert-butyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-methoxyethyl)acetamide N-benzyl-2-(8-tert-butyl-2,4-dio…

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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	9.17	-17.04	1	7	0	79	429.561	8	↓ MOL2 SDF SMILES Flexibase

23038094

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.18	8.7	-21.23	2	8	0	105	435.908	7	↓ MOL2 SDF SMILES Flexibase

23038095

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.18	8.56	-21.32	2	8	0	105	435.908	7	↓ MOL2 SDF SMILES Flexibase

23038096

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.18	8.37	-22.65	2	8	0	105	435.908	7	↓ MOL2 SDF SMILES Flexibase

23038097

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.18	7.56	-20.43	2	8	0	105	435.908	7	↓ MOL2 SDF SMILES Flexibase

23040582

Analogs

5313740

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2,4-dimethylphenyl)methyl]-2-[8-(1,1-dimethylpropyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]-N- N-[(2,4-dimethylphenyl)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)	4.16	11.56	-16.75	1	6	0	70	427.589	6	↓ MOL2 SDF SMILES Flexibase

54703413

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[[2-(4-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetyl]amino]-2-phenyl-acetamide (2S)-2-[[2-(4-methyl-1,3-dioxo-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)	1.32	3.97	-20.05	3	8	0	113	372.425	5	↓ MOL2 SDF SMILES Flexibase

54703415

Analogs

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Popular Name: (2R)-2-[[2-(4-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetyl]amino]-2-phenyl-acetamide (2R)-2-[[2-(4-methyl-1,3-dioxo-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)	1.32	3.97	-19.54	3	8	0	113	372.425	5	↓ MOL2 SDF SMILES Flexibase

37107638

Analogs

37107640
14680082
14680086

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Popular Name: 2-[(5S,6S)-6-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]-N-[(1R)-1-(o-tolyl)ethyl]acetamide 2-[(5S,6S)-6-methyl-1,3-dioxo-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)	3.36	7.05	-13.71	2	6	0	79	357.454	4	↓ MOL2 SDF SMILES Flexibase

37107640

Analogs

37107638

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(5R,6S)-6-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl]-N-[(1R)-1-(o-tolyl)ethyl]acetamide 2-[(5R,6S)-6-methyl-1,3-dioxo-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)	3.36	7.44	-12.79	2	6	0	79	357.454	4	↓ MOL2 SDF SMILES Flexibase

58305184

Analogs

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Popular Name: 2-[8-(1,1-dimethylpropyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]-N-[(1R)-2-methoxy-1-phenyl-ethyl] 2-[8-(1,1-dimethylpropyl)-2,4-di…

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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)	3.76	7.91	-12.12	2	7	0	88	429.561	8	↓ MOL2 SDF SMILES Flexibase

58305185

Analogs

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Popular Name: 2-[8-(1,1-dimethylpropyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]-N-[(1S)-2-methoxy-1-phenyl-ethyl] 2-[8-(1,1-dimethylpropyl)-2,4-di…

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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)	3.76	7.58	-12.6	2	7	0	88	429.561	8	↓ MOL2 SDF SMILES Flexibase

14261228

Analogs

22994151

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-bromophenyl)methyl]-2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-methyl-acetamide N-[(4-bromophenyl)methyl]-2-(1,3…

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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)	2.71	8.05	-14.55	1	6	0	70	408.296	4	↓ MOL2 SDF SMILES Flexibase

14261229

Analogs

9580052

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-chlorophenyl)methyl]-2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-methyl-acetamide N-[(4-chlorophenyl)methyl]-2-(1,…

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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)	2.58	7.94	-14.63	1	6	0	70	363.845	4	↓ MOL2 SDF SMILES Flexibase

14261234

Analogs

14264753
21556522
36768301
8940868
8940873

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-[(4-fluorophenyl)methyl]-N-methyl-acetamide 2-(1,3-dioxo-2,4-diazaspiro[4.5]…

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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)	2.07	7.49	-15.26	1	6	0	70	347.39	4	↓ MOL2 SDF SMILES Flexibase

14261237

Analogs

14261238
22316041
22316044
22316102
22320779

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1-(3,4-dimethylphenyl)ethyl]-2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetamide N-[(1R)-1-(3,4-dimethylphenyl)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)	3.54	7.4	-13.37	2	6	0	79	357.454	4	↓ MOL2 SDF SMILES Flexibase

14261238

Analogs

22316041
22316044
22316102
22320779
22320782

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(3,4-dimethylphenyl)ethyl]-2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetamide N-[(1S)-1-(3,4-dimethylphenyl)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)	3.54	7.4	-13.27	2	6	0	79	357.454	4	↓ MOL2 SDF SMILES Flexibase

14261248

Analogs

23571960
39544456
4287798
4513486

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-[(4-ethoxyphenyl)methyl]-N-methyl-acetamide 2-(1,3-dioxo-2,4-diazaspiro[4.5]…

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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)	2.33	7.65	-16.28	1	7	0	79	373.453	6	↓ MOL2 SDF SMILES Flexibase

14261297

Analogs

14261298
14264834
14264835
15966812
15966813

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide 2-(1,3-dioxo-2,4-diazaspiro[4.5]…

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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)	2.73	5.59	-15.87	2	7	0	88	359.426	5	↓ MOL2 SDF SMILES Flexibase

14261298

Analogs

14261446
14261447
14264834
14264835
15966812

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Popular Name: 2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]acetamide 2-(1,3-dioxo-2,4-diazaspiro[4.5]…

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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)	2.73	5.6	-15.82	2	7	0	88	359.426	5	↓ MOL2 SDF SMILES Flexibase

3592580

Analogs

4513292

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,4-dichlorobenzyl)-2-(2,4-diketo-8-methyl-1,3-diazaspiro[4.5]decan-3-yl)acetamide N-(2,4-dichlorobenzyl)-2-(2,4-di…

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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)	3.21	-2.8	-12.35	2	6	0	78	398.29	4	↓ MOL2 SDF SMILES Flexibase

3592582

Analogs

4308056
36622880
36714344
39544362
39544462

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,4-diketo-8-methyl-1,3-diazaspiro[4.5]decan-3-yl)-N-veratryl-acetamide 2-(2,4-diketo-8-methyl-1,3-diaza…

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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)	1.58	-2.17	-15.67	2	8	0	96	389.452	6	↓ MOL2 SDF SMILES Flexibase

3592614

Analogs

4513353
3433434
3505370
3505399

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-2-(2,4-diketo-8-methyl-1,3-diazaspiro[4.5]decan-3-yl)-N-isopropyl-acetamide N-benzyl-2-(2,4-diketo-8-methyl-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.35	0.03	-13.03	1	6	0	69	371.481	5	↓ MOL2 SDF SMILES Flexibase

14573469

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(2,5-dimethylphenyl)ethyl]-2-(8-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetamide N-[(1S)-1-(2,5-dimethylphenyl)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)	3.31	8.4	-14.08	2	6	0	79	371.481	4	↓ MOL2 SDF SMILES Flexibase

14573470

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1-(2,5-dimethylphenyl)ethyl]-2-(8-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetamide N-[(1R)-1-(2,5-dimethylphenyl)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)	3.31	7.97	-12.88	2	6	0	79	371.481	4	↓ MOL2 SDF SMILES Flexibase

14573471

Analogs

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Popular Name: N-[(1S)-1-(2,5-dimethylphenyl)ethyl]-2-(8-ethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide N-[(1S)-1-(2,5-dimethylphenyl)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)	4.00	8.71	-14.8	2	6	0	79	385.508	5	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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SQL Query Was

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