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Quick Search ZINC ID or SMILES

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ZINC Item

Suppliers, Protomers, & Similar Substances

541

Analogs

2016125
5735782
11681576

Draw Identity 99% 90% 80% 70%

Popular Name: USAN) USAN)

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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)	0.96	1.92	-31.66	1	8	0	104	238.203	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	0.59	-1.35	-22.71	1	8	0	107	238.203	3	↓ MOL2 SDF SMILES Flexibase

751750

Analogs

1513696
1513699
1513716
1513719
4174828

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(3,4-dichlorophenyl)-3-[(4S)-2-keto-1,5,5-trimethyl-3-phenyl-imidazolidin-4-yl]urea 1-(3,4-dichlorophenyl)-3-[(4S)-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)	5.00	-1.5	-16.6	2	6	0	64	407.301	3	↓ MOL2 SDF SMILES Flexibase

751751

Analogs

1513696
1513699
1513716
1513719
4174828

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(3,4-dichlorophenyl)-3-[(4R)-2-keto-1,5,5-trimethyl-3-phenyl-imidazolidin-4-yl]urea 1-(3,4-dichlorophenyl)-3-[(4R)-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)	5.00	-1.43	-14.11	2	6	0	64	407.301	3	↓ MOL2 SDF SMILES Flexibase

5561741

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	1.26	-1.31	-19.03	1	8	0	93	348.746	5	↓ MOL2 SDF SMILES Flexibase

5562324

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	0.51	-4.57	-18.43	3	9	0	116	362.386	7	↓ MOL2 SDF SMILES Flexibase

5778729

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 9,9-dioxo-8-[(2-oxoimidazolidin-1-yl)carbonylmethyl]-9$l^{6}-thia-8-azabicyclo[4.3.0]nona-2,4,10-tri 9,9-dioxo-8-[(2-oxoimidazolidin-…

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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	-7.26	-20.41	1	8	0	103	309.303	2	↓ MOL2 SDF SMILES Flexibase

5778916

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	0.77	-0.12	-21.68	1	9	0	121	319.273	6	↓ MOL2 SDF SMILES Flexibase

5779371

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	0.60	-0.34	-15.53	1	9	0	121	307.262	5	↓ MOL2 SDF SMILES Flexibase

5779839

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.84	-0.01	-14.56	1	6	0	75	352.39	7	↓ MOL2 SDF SMILES Flexibase

5780269

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	1.93	-1.4	-15.81	1	6	0	75	344.392	6	↓ MOL2 SDF SMILES Flexibase

5780458

Analogs

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Popular Name: 1-[2-(5-chlorobenzothiazol-2-yl)sulfanylacetyl]imidazolidin-2-one 1-[2-(5-chlorobenzothiazol-2-yl)…

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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)	2.26	-4.8	-12.19	1	5	0	62	327.818	3	↓ MOL2 SDF SMILES Flexibase

5780782

Analogs

5981173

Draw Identity 99% 90% 80% 70%

Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	2.34	3.37	-11.48	1	6	0	75	384.232	6	↓ MOL2 SDF SMILES Flexibase

5780901

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	0.61	-0.04	-15.76	1	6	0	75	280.255	5	↓ MOL2 SDF SMILES Flexibase

43767209

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-chlorophenyl)methyl]-4-(2-oxoimidazolidin-1-yl)benzamide N-[(4-chlorophenyl)methyl]-4-(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)	2.47	5.87	-13.98	2	5	0	61	329.787	4	↓ MOL2 SDF SMILES Flexibase

6728578

Analogs

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Popular Name: N-(2-methoxyethyl)-2-[3-(o-tolylmethyl)-2-oxo-imidazolidin-1-yl]-acetamide N-(2-methoxyethyl)-2-[3-(o-tolyl…

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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)	1.49	6.09	-18.36	1	6	0	62	305.378	7	↓ MOL2 SDF SMILES Flexibase

6728581

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[[3-methyl-4-(m-tolyl)piperazin-1-yl]carbonylmethyl]-3-(o-tolylmethyl)imidazolidin-2-one 1-[[3-methyl-4-(m-tolyl)piperazi…

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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)	3.59	-0.42	-18.36	0	6	0	47	420.557	5	↓ MOL2 SDF SMILES Flexibase

6728584

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[[3-methyl-4-(m-tolyl)piperazin-1-yl]carbonylmethyl]-3-(o-tolylmethyl)imidazolidin-2-one 1-[[3-methyl-4-(m-tolyl)piperazi…

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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)	3.59	-0.37	-17.72	0	6	0	47	420.557	5	↓ MOL2 SDF SMILES Flexibase

6728587

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(benzo[1,3]dioxol-5-ylmethyl)-2-[3-(m-tolylmethyl)-2-oxo-imidazolidin-1-yl]-acetamide N-(benzo[1,3]dioxol-5-ylmethyl)-…

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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)	2.82	-1.89	-20.31	1	7	0	71	381.432	6	↓ MOL2 SDF SMILES Flexibase

6728598

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(7,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-8-ylmethyl)-2-[3-(m-tolylmethyl)-2-oxo-imidazolidin-1-y N-(7,10-dioxabicyclo[4.4.0]deca-…

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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)	2.67	-2.02	-19.06	1	7	0	71	395.459	6	↓ MOL2 SDF SMILES Flexibase

6728601

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(7,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-8-ylmethyl)-2-[3-(m-tolylmethyl)-2-oxo-imidazolidin-1-y N-(7,10-dioxabicyclo[4.4.0]deca-…

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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)	2.67	-1.96	-20.44	1	7	0	71	395.459	6	↓ MOL2 SDF SMILES Flexibase

6728603

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[[3-methyl-4-(m-tolyl)piperazin-1-yl]carbonylmethyl]-3-(m-tolylmethyl)imidazolidin-2-one 1-[[3-methyl-4-(m-tolyl)piperazi…

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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)	3.62	-1.12	-17.84	0	6	0	47	420.557	5	↓ MOL2 SDF SMILES Flexibase

6728607

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[[3-methyl-4-(m-tolyl)piperazin-1-yl]carbonylmethyl]-3-(m-tolylmethyl)imidazolidin-2-one 1-[[3-methyl-4-(m-tolyl)piperazi…

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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)	3.62	-1.12	-18.59	0	6	0	47	420.557	5	↓ MOL2 SDF SMILES Flexibase

6728610

Analogs

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Popular Name: N-(benzo[1,3]dioxol-5-ylmethyl)-2-[2-oxo-3-(p-tolylmethyl)imidazolidin-1-yl]-acetamide N-(benzo[1,3]dioxol-5-ylmethyl)-…

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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)	2.84	-1.89	-20.36	1	7	0	71	381.432	6	↓ MOL2 SDF SMILES Flexibase

6728613

Analogs

37000917
37000919
37000921
37000924

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-methylcyclohexyl)-2-[2-oxo-3-(p-tolylmethyl)imidazolidin-1-yl]-acetamide N-(2-methylcyclohexyl)-2-[2-oxo-…

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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)	3.70	-0.04	-17.18	1	5	0	52	343.471	5	↓ MOL2 SDF SMILES Flexibase

6728616

Analogs

4930682
4930690
4930697
4930702

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-methylcyclohexyl)-2-[2-oxo-3-(p-tolylmethyl)imidazolidin-1-yl]-acetamide N-(2-methylcyclohexyl)-2-[2-oxo-…

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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)	3.70	-0.58	-17.61	1	5	0	52	343.471	5	↓ MOL2 SDF SMILES Flexibase

6728619

Analogs

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Popular Name: N-(2-methylcyclohexyl)-2-[2-oxo-3-(p-tolylmethyl)imidazolidin-1-yl]-acetamide N-(2-methylcyclohexyl)-2-[2-oxo-…

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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)	3.70	10.12	-19.44	1	5	0	53	343.471	5	↓ MOL2 SDF SMILES Flexibase

6728622

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-methylcyclohexyl)-2-[2-oxo-3-(p-tolylmethyl)imidazolidin-1-yl]-acetamide N-(2-methylcyclohexyl)-2-[2-oxo-…

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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)	3.70	-0.04	-16.94	1	5	0	52	343.471	5	↓ MOL2 SDF SMILES Flexibase

6728624

Analogs

4930737

Draw Identity 99% 90% 80% 70%

Popular Name: N-butyl-2-[2-oxo-3-(p-tolylmethyl)imidazolidin-1-yl]-acetamide N-butyl-2-[2-oxo-3-(p-tolylmethy…

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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	-1	-17.62	1	5	0	52	303.406	7	↓ MOL2 SDF SMILES Flexibase

6728627

Analogs

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Popular Name: N-(7,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-8-ylmethyl)-2-[2-oxo-3-(p-tolylmethyl)imidazolidin-1-yl N-(7,10-dioxabicyclo[4.4.0]deca-…

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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)	2.70	-2.02	-19.2	1	7	0	71	395.459	6	↓ MOL2 SDF SMILES Flexibase

6728630

Analogs

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Popular Name: N-(7,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-8-ylmethyl)-2-[2-oxo-3-(p-tolylmethyl)imidazolidin-1-yl N-(7,10-dioxabicyclo[4.4.0]deca-…

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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)	2.70	-1.97	-20.32	1	7	0	71	395.459	6	↓ MOL2 SDF SMILES Flexibase

6728637

Analogs

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Popular Name: 2-[3-[(3-chlorophenyl)methyl]-2-oxo-imidazolidin-1-yl]-N-(4-methylcyclohexyl)-acetamide 2-[3-[(3-chlorophenyl)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)	3.44	10.13	-20.1	1	5	0	53	363.889	5	↓ MOL2 SDF SMILES Flexibase

6728640

Analogs

4034657

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-[(4-chlorophenyl)methyl]-2-oxo-imidazolidin-1-yl]-N-(2-methylcyclohexyl)-acetamide 2-[3-[(4-chlorophenyl)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)	3.93	-0.51	-16.29	1	5	0	52	363.889	5	↓ MOL2 SDF SMILES Flexibase

6728643

Analogs

4034657

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-[(4-chlorophenyl)methyl]-2-oxo-imidazolidin-1-yl]-N-(2-methylcyclohexyl)-acetamide 2-[3-[(4-chlorophenyl)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)	3.93	-1.05	-17	1	5	0	52	363.889	5	↓ MOL2 SDF SMILES Flexibase

6728646

Analogs

4034657

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Popular Name: 2-[3-[(4-chlorophenyl)methyl]-2-oxo-imidazolidin-1-yl]-N-(2-methylcyclohexyl)-acetamide 2-[3-[(4-chlorophenyl)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)	3.93	-1.06	-17.05	1	5	0	52	363.889	5	↓ MOL2 SDF SMILES Flexibase

6728648

Analogs

4034657

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Popular Name: 2-[3-[(4-chlorophenyl)methyl]-2-oxo-imidazolidin-1-yl]-N-(2-methylcyclohexyl)-acetamide 2-[3-[(4-chlorophenyl)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)	3.93	-0.51	-16.6	1	5	0	52	363.889	5	↓ MOL2 SDF SMILES Flexibase

6728655

Analogs

34858085

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Popular Name: 2-[3-[(2-fluorophenyl)methyl]-2-oxo-imidazolidin-1-yl]-N-phenethyl-acetamide 2-[3-[(2-fluorophenyl)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)	3.02	-0.64	-22.7	1	5	0	52	355.413	7	↓ MOL2 SDF SMILES Flexibase

6728658

Analogs

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Popular Name: N-(benzo[1,3]dioxol-5-ylmethyl)-2-[3-[(4-fluorophenyl)methyl]-2-oxo-imidazolidin-1-yl]-acetamide N-(benzo[1,3]dioxol-5-ylmethyl)-…

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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	-1.48	-20.5	1	7	0	71	385.395	6	↓ MOL2 SDF SMILES Flexibase

6728661

Analogs

21778156
4931569
4931571

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Popular Name: 2-[3-[(2-chloro-4-fluoro-phenyl)methyl]-2-oxo-imidazolidin-1-yl]-N-(4-methylcyclohexyl)-acetamide 2-[3-[(2-chloro-4-fluoro-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)	3.55	9.84	-15.24	1	5	0	53	381.879	5	↓ MOL2 SDF SMILES Flexibase

6728665

Analogs

21778152
21778156

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Popular Name: N-butyl-2-[3-[(2-chloro-4-fluoro-phenyl)methyl]-2-oxo-imidazolidin-1-yl]-acetamide N-butyl-2-[3-[(2-chloro-4-fluoro…

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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	-0.81	-15.44	1	5	0	52	341.814	7	↓ MOL2 SDF SMILES Flexibase

6878842

Analogs

12416630

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Popular Name: 3-(2-hydroxyethyl)-1-[5-(2-hydroxyethylcarbamoylamino)-1,3-dimethyl-2-oxo-imidazolidin-4-yl]-urea 3-(2-hydroxyethyl)-1-[5-(2-hydro…

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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	-14.2	-17.14	6	11	0	146	318.334	6	↓ MOL2 SDF SMILES Flexibase

6878846

Analogs

12416630

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Popular Name: 3-(2-hydroxyethyl)-1-[5-(2-hydroxyethylcarbamoylamino)-1,3-dimethyl-2-oxo-imidazolidin-4-yl]-urea 3-(2-hydroxyethyl)-1-[5-(2-hydro…

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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	-14.18	-17.43	6	11	0	146	318.334	6	↓ MOL2 SDF SMILES Flexibase

7152000

Analogs

39657875

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	0.47	-5.01	-24.07	1	9	0	113	395.437	6	↓ MOL2 SDF SMILES Flexibase

7152715

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	0.85	-0.65	-17.32	2	8	0	104	383.351	7	↓ MOL2 SDF SMILES Flexibase

7450198

Analogs

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Popular Name: ethyl ethyl

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.41	3.01	-14.05	1	6	0	76	246.288	6	↓ MOL2 SDF SMILES Flexibase

7451058

Analogs

7451068

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Popular Name: 1-(2-oxoimidazolidin-1-yl)carbonylethyl 1-(2-oxoimidazolidin-1-yl)carbon…

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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)	1.43	-1.81	-15.45	2	7	0	95	292.291	4	↓ MOL2 SDF SMILES Flexibase

7451068

Analogs

7451058

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Popular Name: 1-(2-oxoimidazolidin-1-yl)carbonylethyl 1-(2-oxoimidazolidin-1-yl)carbon…

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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)	1.43	-1.81	-15.37	2	7	0	95	292.291	4	↓ MOL2 SDF SMILES Flexibase

7722153

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	1.19	-0.95	-12.32	1	6	0	75	345.124	4	↓ MOL2 SDF SMILES Flexibase

7722391

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	2.51	-1.83	-13.98	1	7	0	88	373.434	6	↓ MOL2 SDF SMILES Flexibase

7722741

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	2.29	-1.88	-16.76	1	7	0	88	359.407	6	↓ MOL2 SDF SMILES Flexibase

8980548

Analogs

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Popular Name: (2-oxoimidazolidin-1-yl)carbonylmethyl (2-oxoimidazolidin-1-yl)carbonyl…

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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)	2.55	-3.75	-18.07	1	9	0	113	477.926	9	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

ring.id = 359
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 = 359 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=359&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": "359"        

    });
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