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19432890

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[(4R)-4-ethyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]benzonitrile 3-[[(4R)-4-ethyl-4-methyl-2,5-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)	1.62	5.64	-11.25	1	5	0	73	257.293	3	↓ MOL2 SDF SMILES Flexibase

19432892

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[(4S)-4-ethyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]benzonitrile 3-[[(4S)-4-ethyl-4-methyl-2,5-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)	1.62	5.69	-10.79	1	5	0	73	257.293	3	↓ MOL2 SDF SMILES Flexibase

19432926

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(4S)-2,5-dioxo-4-propyl-imidazolidin-1-yl]methyl]benzenecarbothioamide 4-[[(4S)-2,5-dioxo-4-propyl-imid…

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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)	1.80	4.64	-20.55	3	5	0	75	291.376	5	↓ MOL2 SDF SMILES Flexibase

19432927

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(4R)-2,5-dioxo-4-propyl-imidazolidin-1-yl]methyl]benzenecarbothioamide 4-[[(4R)-2,5-dioxo-4-propyl-imid…

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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)	1.80	4.64	-20.57	3	5	0	75	291.376	5	↓ MOL2 SDF SMILES Flexibase

19434343

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)methyl]-4-fluoro-benzenecarbothioamide 3-[(4,4-dimethyl-2,5-dioxo-imida…

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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)	1.27	3.61	-23.58	3	5	0	75	295.339	3	↓ MOL2 SDF SMILES Flexibase

19435565

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)methyl]benzenecarbothioamide 4-[(4,4-dimethyl-2,5-dioxo-imida…

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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)	1.18	3.68	-20.05	3	5	0	75	277.349	3	↓ MOL2 SDF SMILES Flexibase

19435700

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(2,5-dioxoimidazolidin-1-yl)methyl]-4-fluoro-benzonitrile 3-[(2,5-dioxoimidazolidin-1-yl)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)	0.42	3.47	-13.58	1	5	0	73	233.202	2	↓ MOL2 SDF SMILES Flexibase

19438429

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(4R)-4-ethyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]benzenecarbothioamide 4-[[(4R)-4-ethyl-4-methyl-2,5-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)	1.69	4.46	-19.48	3	5	0	75	291.376	4	↓ MOL2 SDF SMILES Flexibase

19438431

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(4S)-4-ethyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]benzenecarbothioamide 4-[[(4S)-4-ethyl-4-methyl-2,5-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)	1.69	4.48	-19.44	3	5	0	75	291.376	4	↓ MOL2 SDF SMILES Flexibase

19439752

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2,5-dioxoimidazolidin-1-yl)methyl]benzenecarbothioamide 2-[(2,5-dioxoimidazolidin-1-yl)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)	0.33	2.05	-25.16	3	5	0	75	249.295	3	↓ MOL2 SDF SMILES Flexibase

19441020

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(2,5-dioxoimidazolidin-1-yl)methyl]benzenecarbothioamide 4-[(2,5-dioxoimidazolidin-1-yl)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)	0.37	2.3	-21.67	3	5	0	75	249.295	3	↓ MOL2 SDF SMILES Flexibase

19441692

Analogs

8503597

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(4R)-4-ethyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]benzonitrile 2-[[(4R)-4-ethyl-4-methyl-2,5-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)	1.59	5.46	-12.17	1	5	0	73	257.293	3	↓ MOL2 SDF SMILES Flexibase

19441694

Analogs

8503597

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(4S)-4-ethyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]benzonitrile 2-[[(4S)-4-ethyl-4-methyl-2,5-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)	1.59	5.52	-12.16	1	5	0	73	257.293	3	↓ MOL2 SDF SMILES Flexibase

12536997

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(3-aminobenzyl)imidazolidine-2,4-dione 3-(3-aminobenzyl)imidazolidine-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)	-0.37	0.98	-10.03	3	5	0	75	205.217	2	↓ MOL2 SDF SMILES Flexibase

36640876

Analogs

48834767
48834770
31080647

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(2-chloro-4-fluoro-phenyl)methyl]-5,5-dipropyl-imidazolidine-2,4-dione 3-[(2-chloro-4-fluoro-phenyl)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)	4.28	8.27	-6.79	1	4	0	49	326.799	6	↓ MOL2 SDF SMILES Flexibase

53666971

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[4-[(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)methyl]phenyl]methyl]butane-1-sulfonamide N-[[4-[(4,4-dimethyl-2,5-dioxo-i…

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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)	1.75	3.77	-16.07	2	7	0	96	367.471	8	↓ MOL2 SDF SMILES Flexibase

53666972

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[4-[(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)methyl]phenyl]methyl]ethanesulfonamide N-[[4-[(4,4-dimethyl-2,5-dioxo-i…

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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)	0.69	2.19	-16.13	2	7	0	96	339.417	6	↓ MOL2 SDF SMILES Flexibase

22704748

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-diethylaminoethyl)-2-[(2,5-dioxoimidazolidin-1-yl)methyl]benzamide N-(2-diethylaminoethyl)-2-[(2,5-…

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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)	0.50	5.45	-52.16	3	7	1	83	333.412	8	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	0.50	3.23	-20.89	2	7	0	82	332.404	8	↓ MOL2 SDF SMILES Flexibase

22705371

Analogs

42199369
42199371
42199373
42199375
42199377

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(4-bromophenyl)methyl]-5,5-diethyl-imidazolidine-2,4-dione 3-[(4-bromophenyl)methyl]-5,5-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)	3.20	7.09	-8.68	1	4	0	49	325.206	4	↓ MOL2 SDF SMILES Flexibase

22705376

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(3-chlorophenyl)methyl]-5,5-diethyl-imidazolidine-2,4-dione 3-[(3-chlorophenyl)methyl]-5,5-d…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.04	6.97	-9.36	1	4	0	49	280.755	4	↓ MOL2 SDF SMILES Flexibase

22705379

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(2-chlorophenyl)methyl]-5,5-diethyl-imidazolidine-2,4-dione 3-[(2-chlorophenyl)methyl]-5,5-d…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.02	6.7	-9.59	1	4	0	49	280.755	4	↓ MOL2 SDF SMILES Flexibase

22705399

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5,5-diethyl-3-[[3-(trifluoromethyl)phenyl]methyl]imidazolidine-2,4-dione 5,5-diethyl-3-[[3-(trifluorometh…

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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)	3.26	7.45	-9.84	1	4	0	49	314.307	5	↓ MOL2 SDF SMILES Flexibase

22705746

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(3-chlorophenyl)methyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[(3-chlorophenyl)methyl]-5,5-d…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.04	4.98	-9.01	1	4	0	49	252.701	2	↓ MOL2 SDF SMILES Flexibase

22705749

Analogs

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Popular Name: 3-[(2,6-dichlorophenyl)methyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[(2,6-dichlorophenyl)methyl]-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)	2.64	5.23	-9.21	1	4	0	49	287.146	2	↓ MOL2 SDF SMILES Flexibase

22706098

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-3-[(4-fluorophenyl)methyl]-5-isobutyl-imidazolidine-2,4-dione (5S)-3-[(4-fluorophenyl)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)	2.38	6.02	-8.32	1	4	0	49	264.3	4	↓ MOL2 SDF SMILES Flexibase

22706102

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-3-[(4-fluorophenyl)methyl]-5-isobutyl-imidazolidine-2,4-dione (5R)-3-[(4-fluorophenyl)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)	2.38	6	-8.17	1	4	0	49	264.3	4	↓ MOL2 SDF SMILES Flexibase

22743424

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-3-[(3-fluoro-4-methoxy-phenyl)methyl]-5-propyl-imidazolidine-2,4-dione (5S)-3-[(3-fluoro-4-methoxy-phen…

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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)	2.15	4.82	-12.09	1	5	0	59	280.299	5	↓ MOL2 SDF SMILES Flexibase

22743429

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-3-[(3-fluoro-4-methoxy-phenyl)methyl]-5-propyl-imidazolidine-2,4-dione (5R)-3-[(3-fluoro-4-methoxy-phen…

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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)	2.15	4.81	-11.87	1	5	0	59	280.299	5	↓ MOL2 SDF SMILES Flexibase

36875506

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(2,5-dioxo-4,4-dipropyl-imidazolidin-1-yl)methyl]benzonitrile 3-[(2,5-dioxo-4,4-dipropyl-imida…

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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)	3.24	8.25	-10.18	1	5	0	73	299.374	6	↓ MOL2 SDF SMILES Flexibase

36875540

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(3-methoxyphenyl)methyl]-5,5-dipropyl-imidazolidine-2,4-dione 3-[(3-methoxyphenyl)methyl]-5,5-…

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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)	3.54	7.16	-9.83	1	5	0	59	304.39	7	↓ MOL2 SDF SMILES Flexibase

36875541

Analogs

37011530
37011531
36722259
36722260

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(2-methoxy-5-nitro-phenyl)methyl]-5,5-dipropyl-imidazolidine-2,4-dione 3-[(2-methoxy-5-nitro-phenyl)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)	3.45	9.16	-11.32	1	8	0	104	349.387	8	↓ MOL2 SDF SMILES Flexibase

36875548

Analogs

48834883
48834886

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(3-chlorophenyl)methyl]-5,5-dipropyl-imidazolidine-2,4-dione 3-[(3-chlorophenyl)methyl]-5,5-d…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.16	8.37	-7.71	1	4	0	49	308.809	6	↓ MOL2 SDF SMILES Flexibase

36964665

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(2-amino-6-bromo-phenyl)methyl]-1-methyl-imidazolidine-2,4-dione 3-[(2-amino-6-bromo-phenyl)methy…

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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)	1.01	4.22	-8.14	2	5	0	67	298.14	2	↓ MOL2 SDF SMILES Flexibase

36964718

Analogs

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Popular Name: 3-[(3-amino-4-chloro-phenyl)methyl]imidazolidine-2,4-dione 3-[(3-amino-4-chloro-phenyl)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)	0.66	1.55	-9.14	3	5	0	75	239.662	2	↓ MOL2 SDF SMILES Flexibase

36964724

Analogs

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Popular Name: 3-[(3-amino-4-chloro-phenyl)methyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[(3-amino-4-chloro-phenyl)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)	1.47	2.94	-7.49	3	5	0	75	267.716	2	↓ MOL2 SDF SMILES Flexibase

36964808

Analogs

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Popular Name: (5R)-3-[(5-amino-2-chloro-phenyl)methyl]-5-ethyl-5-methyl-imidazolidine-2,4-dione (5R)-3-[(5-amino-2-chloro-phenyl…

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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	3.46	-7.9	3	5	0	75	281.743	3	↓ MOL2 SDF SMILES Flexibase

36964809

Analogs

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Popular Name: (5S)-3-[(5-amino-2-chloro-phenyl)methyl]-5-ethyl-5-methyl-imidazolidine-2,4-dione (5S)-3-[(5-amino-2-chloro-phenyl…

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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	3.53	-8.04	3	5	0	75	281.743	3	↓ MOL2 SDF SMILES Flexibase

36964811

Analogs

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Popular Name: (5R)-3-[(5-amino-2-chloro-phenyl)methyl]-5-propyl-imidazolidine-2,4-dione (5R)-3-[(5-amino-2-chloro-phenyl…

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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)	1.68	3.68	-7.96	3	5	0	75	281.743	4	↓ MOL2 SDF SMILES Flexibase

36964812

Analogs

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Popular Name: (5S)-3-[(5-amino-2-chloro-phenyl)methyl]-5-propyl-imidazolidine-2,4-dione (5S)-3-[(5-amino-2-chloro-phenyl…

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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)	1.68	3.68	-8.17	3	5	0	75	281.743	4	↓ MOL2 SDF SMILES Flexibase

36964904

Analogs

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Popular Name: 3-[(2-chloro-5-nitro-phenyl)methyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[(2-chloro-5-nitro-phenyl)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)	1.95	5.53	-9.87	1	7	0	95	297.698	3	↓ MOL2 SDF SMILES Flexibase

36964906

Analogs

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Popular Name: (5R)-3-[(2-chloro-5-nitro-phenyl)methyl]-5-propyl-imidazolidine-2,4-dione (5R)-3-[(2-chloro-5-nitro-phenyl…

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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)	2.56	6.52	-9.73	1	7	0	95	311.725	5	↓ MOL2 SDF SMILES Flexibase

36964907

Analogs

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Popular Name: (5S)-3-[(2-chloro-5-nitro-phenyl)methyl]-5-propyl-imidazolidine-2,4-dione (5S)-3-[(2-chloro-5-nitro-phenyl…

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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)	2.56	6.52	-9.86	1	7	0	95	311.725	5	↓ MOL2 SDF SMILES Flexibase

68876519

Analogs

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Popular Name: 3-[(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)methyl]-N,N-dimethyl-benzenesulfonamide 3-[(4,4-dimethyl-2,5-dioxo-imida…

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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)	0.67	2.48	-14.01	1	7	0	87	325.39	4	↓ MOL2 SDF SMILES Flexibase

58332035

Analogs

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Popular Name: (5S)-3-[(2-chlorophenyl)methyl]-5-(methoxymethyl)-5-methyl-imidazolidine-2,4-dione (5S)-3-[(2-chlorophenyl)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)	1.62	3.97	-6.46	1	5	0	59	282.727	4	↓ MOL2 SDF SMILES Flexibase

58332037

Analogs

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Popular Name: (5R)-3-[(2-chlorophenyl)methyl]-5-(methoxymethyl)-5-methyl-imidazolidine-2,4-dione (5R)-3-[(2-chlorophenyl)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)	1.62	3.94	-6.44	1	5	0	59	282.727	4	↓ MOL2 SDF SMILES Flexibase

58340895

Analogs

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Popular Name: 3-[(4-isopropoxyphenyl)methyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[(4-isopropoxyphenyl)methyl]-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)	2.18	5.34	-8.22	1	5	0	59	276.336	4	↓ MOL2 SDF SMILES Flexibase

58345402

Analogs

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Popular Name: 2-[[(4S)-4-(methoxymethyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]benzonitrile 2-[[(4S)-4-(methoxymethyl)-4-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)	0.70	3.83	-11.16	1	6	0	82	273.292	4	↓ MOL2 SDF SMILES Flexibase

58345403

Analogs

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Popular Name: 2-[[(4R)-4-(methoxymethyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]benzonitrile 2-[[(4R)-4-(methoxymethyl)-4-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)	0.70	3.81	-11.04	1	6	0	82	273.292	4	↓ MOL2 SDF SMILES Flexibase

4344104

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Notice: Undefined index: field_name in /domains/zinc12/htdocs/lib/zinc/reporter/ZincAuxiliaryInfoReports.php on line 244

Notice: Undefined index: synonym in /domains/zinc12/htdocs/lib/zinc/reporter/ZincAuxiliaryInfoReports.php on line 245

Popular Name:

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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)	0.46	2.37	-8.43	3	5	0	75	233.271	2	↓ MOL2 SDF SMILES Flexibase

52566932

Analogs

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Popular Name: 2-allylsulfanyl-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide 2-allylsulfanyl-N-[3-[(2,5-dioxo…

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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)	0.90	4.7	-15.73	2	6	0	79	319.386	7	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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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 = 24761 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=24761&filter.purchasability=annotated

Embed Link to Results

<div id="zinc-link"></div>
<script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script>
<script type="text/javascript">
    window.zinc.embed('zinc-link', {
        "ring.id": "24761"        

    });
</script>

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