ZINC 12

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ZINC Item

Suppliers, Protomers, & Similar Substances

45619032

Analogs

45619035
45619038
45619040

Draw Identity 99% 90% 80% 70%

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	4.71	-14.37	2	9	0	114	426.425	7	↓ MOL2 SDF SMILES Flexibase

45619035

Analogs

45619038
45619040
45619032

Draw Identity 99% 90% 80% 70%

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	4.76	-14.15	2	9	0	114	426.425	7	↓ MOL2 SDF SMILES Flexibase

45619038

Analogs

45619040
45619032
45619035

Draw Identity 99% 90% 80% 70%

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	4.43	-15.3	2	9	0	114	426.425	7	↓ MOL2 SDF SMILES Flexibase

45619040

Analogs

45619032
45619035
45619038

Draw Identity 99% 90% 80% 70%

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	4.48	-15.01	2	9	0	114	426.425	7	↓ MOL2 SDF SMILES Flexibase

20895792

Analogs

20895794
21742713
21742716
22026227
22026228

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4R)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-(4-methylcyclohexyl)acetamide 2-[(4R)-2',5'-dioxospiro[chroman…

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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)	2.25	5.5	-15.32	2	7	0	88	371.437	3	↓ MOL2 SDF SMILES Flexibase

20895794

Analogs

21742713
21742716
22026227
22026228
20895792

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4S)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-(4-methylcyclohexyl)acetamide 2-[(4S)-2',5'-dioxospiro[chroman…

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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)	2.25	6.2	-13.11	2	7	0	88	371.437	3	↓ MOL2 SDF SMILES Flexibase

20895796

Analogs

20895799

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-[2-(2,4-dimethoxyphenyl)-2-oxo-ethyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4R)-3'-[2-(2,4-dimethoxyphenyl)…

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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)	2.16	6.48	-20.42	1	8	0	94	396.399	5	↓ MOL2 SDF SMILES Flexibase

20895799

Analogs

20895796

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-[2-(2,4-dimethoxyphenyl)-2-oxo-ethyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4S)-3'-[2-(2,4-dimethoxyphenyl)…

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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)	2.16	6.81	-19.75	1	8	0	94	396.399	5	↓ MOL2 SDF SMILES Flexibase

36213108

Analogs

36213110

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-[2-(4-isopropyl-3-methyl-phenoxy)ethyl]spiro[chromane-4,5'-imidazolidine]-2',4'-dione (4S)-3'-[2-(4-isopropyl-3-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)	4.07	8.85	-9.86	1	6	0	68	394.471	5	↓ MOL2 SDF SMILES Flexibase

36213110

Analogs

36213108

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-[2-(4-isopropyl-3-methyl-phenoxy)ethyl]spiro[chromane-4,5'-imidazolidine]-2',4'-dione (4R)-3'-[2-(4-isopropyl-3-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)	4.07	8.57	-10.93	1	6	0	68	394.471	5	↓ MOL2 SDF SMILES Flexibase

36329785

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]spiro[chromane-4,5'-imidazolidine]-2',4'-di (4S)-3'-[2-[4-(2-nitrophenyl)pip…

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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)	1.82	8.79	-20.13	1	11	0	128	465.466	4	↓ MOL2 SDF SMILES Flexibase

36329786

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]spiro[chromane-4,5'-imidazolidine]-2',4'-di (4R)-3'-[2-[4-(2-nitrophenyl)pip…

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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)	1.82	8.55	-19.56	1	11	0	128	465.466	4	↓ MOL2 SDF SMILES Flexibase

12855142

Analogs

12855149
12855155
12855163

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4R)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-[(4R)-thiochroman-4-yl]acetamide 2-[(4R)-2',5'-dioxospiro[chroman…

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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)	1.77	6.64	-16.11	2	7	0	88	423.494	3	↓ MOL2 SDF SMILES Flexibase

12855149

Analogs

12855155
12855163
12855142

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4S)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-[(4R)-thiochroman-4-yl]acetamide 2-[(4S)-2',5'-dioxospiro[chroman…

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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)	1.77	6.95	-15.88	2	7	0	88	423.494	3	↓ MOL2 SDF SMILES Flexibase

12855155

Analogs

12855163
12855142
12855149

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4R)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-[(4S)-thiochroman-4-yl]acetamide 2-[(4R)-2',5'-dioxospiro[chroman…

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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)	1.77	6.61	-15.53	2	7	0	88	423.494	3	↓ MOL2 SDF SMILES Flexibase

12855163

Analogs

12855142
12855149
12855155

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4S)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-[(4S)-thiochroman-4-yl]acetamide 2-[(4S)-2',5'-dioxospiro[chroman…

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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)	1.77	6.88	-15.81	2	7	0	88	423.494	3	↓ MOL2 SDF SMILES Flexibase

12855452

Analogs

12855457
12855462
12855469

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-[(2R)-3-(4-bromophenoxy)-2-hydroxy-propyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4R)-3'-[(2R)-3-(4-bromophenoxy)…

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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)	2.81	4.37	-11.74	2	7	0	88	447.285	5	↓ MOL2 SDF SMILES Flexibase

12855457

Analogs

12855462
12855469
12855452

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-[(2S)-3-(4-bromophenoxy)-2-hydroxy-propyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4R)-3'-[(2S)-3-(4-bromophenoxy)…

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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)	2.81	4.43	-12	2	7	0	88	447.285	5	↓ MOL2 SDF SMILES Flexibase

12855462

Analogs

12855469
12855452
12855457

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-[(2R)-3-(4-bromophenoxy)-2-hydroxy-propyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4S)-3'-[(2R)-3-(4-bromophenoxy)…

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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)	2.81	4.64	-11.17	2	7	0	88	447.285	5	↓ MOL2 SDF SMILES Flexibase

12855469

Analogs

12855452
12855457

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-[(2S)-3-(4-bromophenoxy)-2-hydroxy-propyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4S)-3'-[(2S)-3-(4-bromophenoxy)…

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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)	2.81	4.69	-10.97	2	7	0	88	447.285	5	↓ MOL2 SDF SMILES Flexibase

12855475

Analogs

12855484
12855490
12855496

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-[(2R)-3-(2,4-dichlorophenoxy)-2-hydroxy-propyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4R)-3'-[(2R)-3-(2,4-dichlorophe…

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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)	3.29	4.82	-12.97	2	7	0	88	437.279	5	↓ MOL2 SDF SMILES Flexibase

12855484

Analogs

12855490
12855496
12855475

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-[(2S)-3-(2,4-dichlorophenoxy)-2-hydroxy-propyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4R)-3'-[(2S)-3-(2,4-dichlorophe…

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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)	3.29	4.89	-12.96	2	7	0	88	437.279	5	↓ MOL2 SDF SMILES Flexibase

12855490

Analogs

12855496
12855475
12855484

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-[(2R)-3-(2,4-dichlorophenoxy)-2-hydroxy-propyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4S)-3'-[(2R)-3-(2,4-dichlorophe…

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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)	3.29	5.09	-12.43	2	7	0	88	437.279	5	↓ MOL2 SDF SMILES Flexibase

12855496

Analogs

12855475
12855484
12855490

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-[(2S)-3-(2,4-dichlorophenoxy)-2-hydroxy-propyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4S)-3'-[(2S)-3-(2,4-dichlorophe…

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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)	3.29	5.13	-12.21	2	7	0	88	437.279	5	↓ MOL2 SDF SMILES Flexibase

22709461

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]spiro[chroman-4,5'-imidazolidine]-2',4 (4R)-3'-[[3-(3,4-dimethoxyphenyl…

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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)	2.12	4.4	-17.08	1	10	0	116	436.424	5	↓ MOL2 SDF SMILES Flexibase

22709465

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]spiro[chroman-4,5'-imidazolidine]-2',4 (4S)-3'-[[3-(3,4-dimethoxyphenyl…

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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)	2.12	4.66	-15.47	1	10	0	116	436.424	5	↓ MOL2 SDF SMILES Flexibase

13013173

Analogs

13013174

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-[[5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl]spiro[chroman-4,5'-imidazolidine]-2',4'-di (4R)-3'-[[5-(5-bromo-2-furyl)-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)	1.87	1.19	-13.2	1	9	0	111	445.229	3	↓ MOL2 SDF SMILES Flexibase

13013174

Analogs

13013173

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-[[5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl]spiro[chroman-4,5'-imidazolidine]-2',4'-di (4S)-3'-[[5-(5-bromo-2-furyl)-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)	1.87	1.45	-12.5	1	9	0	111	445.229	3	↓ MOL2 SDF SMILES Flexibase

13014335

Analogs

3545676
3545677
3545678

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(4S)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]acetyl]-ethyl-amino]-N-[(4-fluorophen 2-[[2-[(4S)-2',5'-dioxospiro[chr…

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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)	1.87	7.29	-20.62	2	9	0	108	468.485	7	↓ MOL2 SDF SMILES Flexibase

54425025

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3'-(2-butoxyethyl)spiro[chromane-4,5'-imidazolidine]-2',4'-dione (4S)-3'-(2-butoxyethyl)spiro[chr…

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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)	2.39	5.4	-8.7	1	6	0	68	318.373	6	↓ MOL2 SDF SMILES Flexibase

54425027

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3'-(2-butoxyethyl)spiro[chromane-4,5'-imidazolidine]-2',4'-dione (4R)-3'-(2-butoxyethyl)spiro[chr…

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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)	2.39	5.12	-9.7	1	6	0	68	318.373	6	↓ MOL2 SDF SMILES Flexibase

54427567

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-cyclohexyl-3-[(4S)-2',5'-dioxospiro[chromane-4,4'-imidazolidine]-1'-yl]propanamide N-cyclohexyl-3-[(4S)-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)	2.25	5.54	-12.01	2	7	0	88	371.437	4	↓ MOL2 SDF SMILES Flexibase

54427569

Analogs

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Popular Name: N-cyclohexyl-3-[(4R)-2',5'-dioxospiro[chromane-4,4'-imidazolidine]-1'-yl]propanamide N-cyclohexyl-3-[(4R)-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)	2.25	5.3	-13.23	2	7	0	88	371.437	4	↓ MOL2 SDF SMILES Flexibase

62579993

Analogs

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Popular Name: (4R)-3'-[[2-(4-fluorophenyl)thiazol-4-yl]methyl]spiro[chromane-4,5'-imidazolidine]-2',4'-dione (4R)-3'-[[2-(4-fluorophenyl)thia…

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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	7.44	-10.57	1	6	0	72	409.442	3	↓ MOL2 SDF SMILES Flexibase

23935014

Analogs

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Popular Name: 2-[(4R)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)acetam 2-[(4R)-2',5'-dioxospiro[chroman…

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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	5.28	-24.77	2	8	0	101	422.466	3	↓ MOL2 SDF SMILES Flexibase

23935018

Analogs

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Popular Name: 2-[(4S)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)acetam 2-[(4S)-2',5'-dioxospiro[chroman…

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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	5.61	-24.09	2	8	0	101	422.466	3	↓ MOL2 SDF SMILES Flexibase

24569499

Analogs

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Popular Name: (4R)-3'-[(5-fluoro-8-quinolyl)methyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4R)-3'-[(5-fluoro-8-quinolyl)me…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.74	7.56	-11.86	1	6	0	72	377.375	2	↓ MOL2 SDF SMILES Flexibase

24569501

Analogs

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Popular Name: (4S)-3'-[(5-fluoro-8-quinolyl)methyl]spiro[chroman-4,5'-imidazolidine]-2',4'-dione (4S)-3'-[(5-fluoro-8-quinolyl)me…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.74	7.87	-11.2	1	6	0	72	377.375	2	↓ MOL2 SDF SMILES Flexibase

24992336

Analogs

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Popular Name: 2-[[(4R)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]methyl]-1-ethyl-N,N-dimethyl-benzimidazo 2-[[(4R)-2',5'-dioxospiro[chroma…

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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)	1.70	5.68	-20.34	1	10	0	114	483.55	5	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.70	6.08	-38.6	2	10	1	115	484.558	5	↓ MOL2 SDF SMILES Flexibase

24992339

Analogs

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Popular Name: 2-[[(4S)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]methyl]-1-ethyl-N,N-dimethyl-benzimidazo 2-[[(4S)-2',5'-dioxospiro[chroma…

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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)	1.70	5.97	-19.95	1	10	0	114	483.55	5	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.70	6.36	-38.27	2	10	1	115	484.558	5	↓ MOL2 SDF SMILES Flexibase

58328570

Analogs

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Popular Name: (4S)-3'-[(2S)-3-[benzyl(methyl)amino]-2-hydroxy-propyl]spiro[chromane-4,5'-imidazolidine]-2',4'-dion (4S)-3'-[(2S)-3-[benzyl(methyl)a…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.75	6.23	-44.02	3	7	1	83	396.467	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.75	3.87	-9.94	2	7	0	82	395.459	6	↓ MOL2 SDF SMILES Flexibase

58328572

Analogs

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Popular Name: (4S)-3'-[(2R)-3-[benzyl(methyl)amino]-2-hydroxy-propyl]spiro[chromane-4,5'-imidazolidine]-2',4'-dion (4S)-3'-[(2R)-3-[benzyl(methyl)a…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.75	6.23	-42.96	3	7	1	83	396.467	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.75	3.9	-9.66	2	7	0	82	395.459	6	↓ MOL2 SDF SMILES Flexibase

14013828

Analogs

8945517
8945519

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Popular Name: (4R)-3'-[2-[(3R,5R)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl]spiro[chroman-4,5'-imidazolidine]-2',4'-di (4R)-3'-[2-[(3R,5R)-3,5-dimethyl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.94	6.74	-13.92	1	7	0	79	371.437	2	↓ MOL2 SDF SMILES Flexibase

14013834

Analogs

8945517
8945519

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Popular Name: (4R)-3'-[2-[(3S,5R)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl]spiro[chroman-4,5'-imidazolidine]-2',4'-di (4R)-3'-[2-[(3S,5R)-3,5-dimethyl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.94	6.49	-14.98	1	7	0	79	371.437	2	↓ MOL2 SDF SMILES Flexibase

14013837

Analogs

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Popular Name: (4R)-3'-[2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl]spiro[chroman-4,5'-imidazolidine]-2',4'-di (4R)-3'-[2-[(3S,5S)-3,5-dimethyl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.94	6.75	-14.37	1	7	0	79	371.437	2	↓ MOL2 SDF SMILES Flexibase

14227303

Analogs

14227306

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Popular Name: N-[2-[5-[2-[(4R)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]acetyl]-2-thienyl]ethyl]methanes N-[2-[5-[2-[(4R)-2',5'-dioxospir…

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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	3.48	-23.88	2	9	0	122	463.537	7	↓ MOL2 SDF SMILES Flexibase

14227306

Analogs

14227303

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[5-[2-[(4S)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]acetyl]-2-thienyl]ethyl]methanes N-[2-[5-[2-[(4S)-2',5'-dioxospir…

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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	3.76	-23.48	2	9	0	122	463.537	7	↓ MOL2 SDF SMILES Flexibase

14228239

Analogs

14228242
14228245
14228248

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Popular Name: 2-[(4R)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-[(R)-(4-ethylphenyl)-(3-fluorophenyl)m 2-[(4R)-2',5'-dioxospiro[chroman…

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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)	4.81	10.78	-15.71	2	7	0	88	487.531	6	↓ MOL2 SDF SMILES Flexibase

14228242

Analogs

14228245
14228248
14228239

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Popular Name: 2-[(4R)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-[(S)-(4-ethylphenyl)-(3-fluorophenyl)m 2-[(4R)-2',5'-dioxospiro[chroman…

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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)	4.81	10.75	-18.16	2	7	0	88	487.531	6	↓ MOL2 SDF SMILES Flexibase

14228245

Analogs

14228248
14228239
14228242

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Popular Name: 2-[(4S)-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-1'-yl]-N-[(R)-(4-ethylphenyl)-(3-fluorophenyl)m 2-[(4S)-2',5'-dioxospiro[chroman…

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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)	4.81	11.04	-14.9	2	7	0	88	487.531	6	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
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SQL Query Was

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