ZINC02390580 | ZINC Is Not Commercial - A database of commercially-available compounds

In ZINC since	Heavy atoms	Benign functionality
October 24^th, 2004	29	Yes

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)	1.89	-1.13	-19.97	1	7	0	91	390.395	3	↓ MOL2 SDF SMILES Flexibase

6810736

Analogs

8612104
8612105
16742334
16742335
33889160

Popular Name: 2-methoxyethyl-dimethyl-BLAHtrione 2-methoxyethyl-dimethyl-BLAHtrione

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Vendors

And 9 More

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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	8.46	-16.21	0	7	0	80	404.422	3	↓ MOL2 SDF SMILES Flexibase

More about ZINC06810736

9432002

Analogs

33764326
33764327
39889579
39889582
39889583

Popular Name: 2-hydroxyethyl-dimethyl-BLAHtrione 2-hydroxyethyl-dimethyl-BLAHtrione

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Vendors

And 6 More

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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	-0.19	-17.26	1	7	0	91	390.395	2	↓ MOL2 SDF SMILES Flexibase

More about ZINC09432002

9432003

Analogs

33738359
33738360
33764326
33764327
34380482

Popular Name: 2-hydroxyethyl-dimethyl-BLAHtrione 2-hydroxyethyl-dimethyl-BLAHtrione

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Vendors

And 6 More

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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	0.08	-16.67	1	7	0	91	390.395	2	↓ MOL2 SDF SMILES Flexibase

More about ZINC09432003

33738359

Analogs

5561832

Popular Name: (1S)-2-[(2-chlorophenyl)methyl]-1'-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-2-[(2-chlorophenyl)methyl]-…

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Vendors

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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)	4.17	11.63	-18.62	0	6	0	71	456.885	2	↓ MOL2 SDF SMILES Flexibase

More about ZINC33738359

33738360

Analogs

5561832

Popular Name: (1R)-2-[(2-chlorophenyl)methyl]-1'-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-[(2-chlorophenyl)methyl]-…

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Vendors

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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)	4.17	11.82	-17.91	0	6	0	71	456.885	2	↓ MOL2 SDF SMILES Flexibase

More about ZINC33738360

34380482

Analogs

5561832

Popular Name: (1S)-2-[(2-chlorophenyl)methyl]-1'-ethyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-2-[(2-chlorophenyl)methyl]-…

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Vendors

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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)	4.55	12.33	-16.74	0	6	0	71	470.912	3	↓ MOL2 SDF SMILES Flexibase

More about ZINC34380482

34380484

Analogs

5561832

Popular Name: (1R)-2-[(2-chlorophenyl)methyl]-1'-ethyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-[(2-chlorophenyl)methyl]-…

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Vendors

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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)	4.55	12.64	-18.47	0	6	0	71	470.912	3	↓ MOL2 SDF SMILES Flexibase

More about ZINC34380484

39889579

Analogs

2210847

Popular Name: (1R)-1'-benzyl-2-(2-hydroxyethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-1'-benzyl-2-(2-hydroxyethyl…

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Vendors

Innovapharm Make-on-Demand
- VT-00199878
PubChem
- 18867352

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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)	2.91	8.98	-21.49	1	7	0	91	452.466	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889579

39889582

Analogs

2390580

Popular Name: (1R)-1'-benzyl-2-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-1'-benzyl-2-(p-tolylmethyl)…

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Vendors

Innovapharm Make-on-Demand
- VT-00199881
PubChem
- 18867355

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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)	5.39	15.67	-18	0	6	0	71	512.565	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889582

39889583

Analogs

2390580

Popular Name: (1S)-1'-benzyl-2-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-1'-benzyl-2-(p-tolylmethyl)…

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Vendors

Innovapharm Make-on-Demand
- VT-00199881
PubChem
- 18867355

Draw Identity 99% 90% 80% 70%

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)	5.39	16.09	-17.82	0	6	0	71	512.565	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889583

39889600

Analogs

16742178

Popular Name: (1S)-2-(2-furylmethyl)-1'-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-2-(2-furylmethyl)-1'-(p-tol…

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Vendors

Innovapharm Make-on-Demand
- VT-00199912
PubChem
- 18867385

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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)	4.65	13.84	-17.05	0	7	0	84	502.526	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889600

39889601

Analogs

16742178

Popular Name: (1R)-2-(2-furylmethyl)-1'-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-(2-furylmethyl)-1'-(p-tol…

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Vendors

Innovapharm Make-on-Demand
- VT-00199912
PubChem
- 18867385

Draw Identity 99% 90% 80% 70%

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)	4.65	14.21	-18.85	0	7	0	84	502.526	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889601

39889616

Analogs

2210847

Popular Name: (1S)-2-(2-hydroxyethyl)-1'-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-2-(2-hydroxyethyl)-1'-(p-to…

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Vendors

Innovapharm Make-on-Demand
- VT-00199923
PubChem
- 18867396

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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	9.71	-18.95	1	7	0	91	466.493	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889616

39889617

Analogs

2210847

Popular Name: (1R)-2-(2-hydroxyethyl)-1'-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-(2-hydroxyethyl)-1'-(p-to…

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Vendors

Innovapharm Make-on-Demand
- VT-00199923
PubChem
- 18867396

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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	9.66	-21.68	1	7	0	91	466.493	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889617

39889618

Analogs

2390580

Popular Name: (1S)-2-benzyl-1'-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-2-benzyl-1'-(p-tolylmethyl)…

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Vendors

Innovapharm Make-on-Demand
- VT-00199924
PubChem
- 18867397

Draw Identity 99% 90% 80% 70%

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)	5.39	15.93	-17.19	0	6	0	71	512.565	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889618

39889619

Analogs

2390580

Popular Name: (1R)-2-benzyl-1'-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-benzyl-1'-(p-tolylmethyl)…

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Vendors

Innovapharm Make-on-Demand
- VT-00199924
PubChem
- 18867397

Draw Identity 99% 90% 80% 70%

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)	5.39	15.65	-18.93	0	6	0	71	512.565	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889619

39889668

Analogs

2210847

Popular Name: (1S)-1'-[(4-chlorophenyl)methyl]-2-(2-hydroxyethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3, (1S)-1'-[(4-chlorophenyl)methyl]…

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Vendors

Innovapharm Make-on-Demand
- VT-00200013
PubChem
- 18867486

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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	10.21	-18.43	1	7	0	91	486.911	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889668

39889669

Analogs

2210847

Popular Name: (1R)-1'-[(4-chlorophenyl)methyl]-2-(2-hydroxyethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3, (1R)-1'-[(4-chlorophenyl)methyl]…

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Vendors

Innovapharm Make-on-Demand
- VT-00200013
PubChem
- 18867486

Draw Identity 99% 90% 80% 70%

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	11.55	-15.21	1	7	0	91	486.911	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889669

39889682

Analogs

9431999

Popular Name: (1S)-1'-[(2-chlorophenyl)methyl]-2-(2-hydroxyethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3, (1S)-1'-[(2-chlorophenyl)methyl]…

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Vendors

Innovapharm Make-on-Demand
- VT-00200058
PubChem
- 18867531

Draw Identity 99% 90% 80% 70%

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	9.36	-21.58	1	7	0	91	486.911	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889682

39889683

Analogs

9431999

Popular Name: (1R)-1'-[(2-chlorophenyl)methyl]-2-(2-hydroxyethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3, (1R)-1'-[(2-chlorophenyl)methyl]…

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Vendors

Innovapharm Make-on-Demand
- VT-00200058
PubChem
- 18867531

Draw Identity 99% 90% 80% 70%

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	9.31	-21.74	1	7	0	91	486.911	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889683

39889704

Analogs

2210847

Popular Name: (1S)-2-(2-hydroxyethyl)-1'-(o-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-2-(2-hydroxyethyl)-1'-(o-to…

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Vendors

Innovapharm Make-on-Demand
- VT-00200103
PubChem
- 18867576

Draw Identity 99% 90% 80% 70%

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	9.92	-18.37	1	7	0	91	466.493	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889704

39889705

Analogs

2210847

Popular Name: (1R)-2-(2-hydroxyethyl)-1'-(o-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-(2-hydroxyethyl)-1'-(o-to…

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Vendors

Innovapharm Make-on-Demand
- VT-00200103
PubChem
- 18867576

Draw Identity 99% 90% 80% 70%

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	9.76	-19.5	1	7	0	91	466.493	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889705

39889718

Analogs

16742178

Popular Name: (1S)-2-(2-furylmethyl)-1'-(m-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-2-(2-furylmethyl)-1'-(m-tol…

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Vendors

Innovapharm Make-on-Demand
- VT-00200137
PubChem
- 18867610

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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)	4.62	14.32	-18.81	0	7	0	84	502.526	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889718

39889719

Analogs

16742178

Popular Name: (1R)-2-(2-furylmethyl)-1'-(m-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-(2-furylmethyl)-1'-(m-tol…

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Vendors

Innovapharm Make-on-Demand
- VT-00200137
PubChem
- 18867610

Draw Identity 99% 90% 80% 70%

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)	4.62	14.2	-18.86	0	7	0	84	502.526	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889719

39889734

Analogs

2390580

Popular Name: (1S)-2-(2-hydroxyethyl)-1'-(m-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-2-(2-hydroxyethyl)-1'-(m-to…

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Vendors

Innovapharm Make-on-Demand
- VT-00200148
PubChem
- 18867621

Draw Identity 99% 90% 80% 70%

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)	3.34	9.7	-19	1	7	0	91	466.493	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889734

39889735

Analogs

2390580

Popular Name: (1R)-2-(2-hydroxyethyl)-1'-(m-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-(2-hydroxyethyl)-1'-(m-to…

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Vendors

Innovapharm Make-on-Demand
- VT-00200148
PubChem
- 18867621

Draw Identity 99% 90% 80% 70%

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)	3.34	9.65	-21.58	1	7	0	91	466.493	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39889735

39890326

Analogs

2210847

Popular Name: (1S)-1'-ethyl-2-(2-hydroxyethyl)-7-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-1'-ethyl-2-(2-hydroxyethyl)…

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Vendors

Innovapharm Make-on-Demand
- VT-00201318
PubChem
- 18868686

Draw Identity 99% 90% 80% 70%

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)	2.31	6.75	-18.41	1	7	0	91	404.422	3	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890326

39890330

Analogs

9432002

Popular Name: (1S)-1'-ethyl-7-methyl-2-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-1'-ethyl-7-methyl-2-(p-toly…

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Vendors

Innovapharm Make-on-Demand
- VT-00201321
PubChem
- 18868687

Draw Identity 99% 90% 80% 70%

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)	4.79	13.66	-15.85	0	6	0	71	464.521	3	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890330

39890331

Analogs

9432002

Popular Name: (1R)-1'-ethyl-7-methyl-2-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-1'-ethyl-7-methyl-2-(p-toly…

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Vendors

Innovapharm Make-on-Demand
- VT-00201321
PubChem
- 18868687

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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)	4.79	13.36	-16.83	0	6	0	71	464.521	3	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890331

39890370

Analogs

9432002

Popular Name: (1R)-1',7-dimethyl-2-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-1',7-dimethyl-2-(p-tolylmet…

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Vendors

Innovapharm Make-on-Demand
- VT-00201366
PubChem
- 18868719

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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)	4.42	12.44	-16.56	0	6	0	71	450.494	2	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890370

39890500

Analogs

2210847

Popular Name: (1S)-1'-benzyl-2-(2-hydroxyethyl)-7-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-1'-benzyl-2-(2-hydroxyethyl…

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Vendors

Innovapharm Make-on-Demand
- VT-00201498
PubChem
- 18868825

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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)	3.34	10.36	-18.63	1	7	0	91	466.493	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890500

39890501

Analogs

2210847

Popular Name: (1R)-1'-benzyl-2-(2-hydroxyethyl)-7-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-1'-benzyl-2-(2-hydroxyethyl…

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Vendors

Innovapharm Make-on-Demand
- VT-00201498
PubChem
- 18868825

Draw Identity 99% 90% 80% 70%

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)	3.34	11.7	-14.94	1	7	0	91	466.493	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890501

39890514

Analogs

16742178

Popular Name: (1S)-2-(2-furylmethyl)-7-methyl-1'-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9 (1S)-2-(2-furylmethyl)-7-methyl-…

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Vendors

Innovapharm Make-on-Demand
- VT-00201532
PubChem
- 18868859

Draw Identity 99% 90% 80% 70%

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)	5.07	14.5	-16.62	0	7	0	84	516.553	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890514

39890515

Analogs

16742178

Popular Name: (1R)-2-(2-furylmethyl)-7-methyl-1'-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9 (1R)-2-(2-furylmethyl)-7-methyl-…

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Vendors

Innovapharm Make-on-Demand
- VT-00201532
PubChem
- 18868859

Draw Identity 99% 90% 80% 70%

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)	5.07	14.88	-18.5	0	7	0	84	516.553	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890515

39890528

Analogs

2210847

Popular Name: (1S)-2-(2-hydroxyethyl)-7-methyl-1'-(p-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3, (1S)-2-(2-hydroxyethyl)-7-methyl…

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Vendors

Innovapharm Make-on-Demand
- VT-00201543
PubChem
- 18868870

Draw Identity 99% 90% 80% 70%

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)	3.78	10.38	-18.47	1	7	0	91	480.52	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890528

39890564

Analogs

2210847

Popular Name: (1S)-1'-[(4-chlorophenyl)methyl]-2-(2-hydroxyethyl)-7-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indol (1S)-1'-[(4-chlorophenyl)methyl]…

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Vendors

Innovapharm Make-on-Demand
- VT-00201633
PubChem
- 18868960

Draw Identity 99% 90% 80% 70%

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)	4.01	10.88	-18.08	1	7	0	91	500.938	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890564

39890565

Analogs

2210847

Popular Name: (1R)-1'-[(4-chlorophenyl)methyl]-2-(2-hydroxyethyl)-7-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indol (1R)-1'-[(4-chlorophenyl)methyl]…

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Vendors

Innovapharm Make-on-Demand
- VT-00201633
PubChem
- 18868960

Draw Identity 99% 90% 80% 70%

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)	4.01	12.22	-14.85	1	7	0	91	500.938	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890565

39890576

Analogs

9431999

Popular Name: (1S)-1'-[(2-chlorophenyl)methyl]-2-(2-hydroxyethyl)-7-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indol (1S)-1'-[(2-chlorophenyl)methyl]…

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Vendors

Innovapharm Make-on-Demand
- VT-00201678
PubChem
- 18869005

Draw Identity 99% 90% 80% 70%

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)	3.97	10.74	-19.32	1	7	0	91	500.938	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890576

39890577

Analogs

9431999

Popular Name: (1R)-1'-[(2-chlorophenyl)methyl]-2-(2-hydroxyethyl)-7-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indol (1R)-1'-[(2-chlorophenyl)methyl]…

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Vendors

Innovapharm Make-on-Demand
- VT-00201678
PubChem
- 18869005

Draw Identity 99% 90% 80% 70%

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)	3.97	11.45	-15.28	1	7	0	91	500.938	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890577

39890596

Analogs

2210847

Popular Name: (1S)-2-(2-hydroxyethyl)-7-methyl-1'-(o-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3, (1S)-2-(2-hydroxyethyl)-7-methyl…

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Vendors

Innovapharm Make-on-Demand
- VT-00201723
PubChem
- 18869379

Draw Identity 99% 90% 80% 70%

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)	3.74	11.24	-17.36	1	7	0	91	480.52	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890596

39890597

Analogs

2210847

Popular Name: (1R)-2-(2-hydroxyethyl)-7-methyl-1'-(o-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3, (1R)-2-(2-hydroxyethyl)-7-methyl…

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Vendors

Innovapharm Make-on-Demand
- VT-00201723
PubChem
- 18869379

Draw Identity 99% 90% 80% 70%

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)	3.74	11.5	-16.99	1	7	0	91	480.52	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890597

39890606

Analogs

16742178

Popular Name: (1S)-2-(2-furylmethyl)-7-methyl-1'-(m-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9 (1S)-2-(2-furylmethyl)-7-methyl-…

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Vendors

Innovapharm Make-on-Demand
- VT-00201757
PubChem
- 18869413

Draw Identity 99% 90% 80% 70%

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)	5.05	14.98	-18.54	0	7	0	84	516.553	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890606

39890607

Analogs

16742178

Popular Name: (1R)-2-(2-furylmethyl)-7-methyl-1'-(m-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9 (1R)-2-(2-furylmethyl)-7-methyl-…

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Vendors

Innovapharm Make-on-Demand
- VT-00201757
PubChem
- 18869413

Draw Identity 99% 90% 80% 70%

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)	5.05	14.86	-18.49	0	7	0	84	516.553	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890607

39890620

Analogs

2390580

Popular Name: (1S)-2-(2-hydroxyethyl)-7-methyl-1'-(m-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3, (1S)-2-(2-hydroxyethyl)-7-methyl…

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Vendors

Innovapharm Make-on-Demand
- VT-00201768
PubChem
- 18869424

Draw Identity 99% 90% 80% 70%

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	10.37	-18.57	1	7	0	91	480.52	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890620

39890621

Analogs

2390580

Popular Name: (1R)-2-(2-hydroxyethyl)-7-methyl-1'-(m-tolylmethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3, (1R)-2-(2-hydroxyethyl)-7-methyl…

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Vendors

Innovapharm Make-on-Demand
- VT-00201768
PubChem
- 18869424

Draw Identity 99% 90% 80% 70%

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	10.31	-21.23	1	7	0	91	480.52	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC39890621

2390578

Analogs

2390580
6810736
9432002
9432003
33764326

Popular Name: BRD-A23212293-001-01-5 BRD-A23212293-001-01-5

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And 8 More

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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)	1.89	-1.18	-19.92	1	7	0	91	390.395	3	↓ MOL2 SDF SMILES Flexibase

More about ZINC02390578

2210847

Analogs

2390578
2390580
33738359
33738360
33764326

Popular Name: (1S)-2-(2-hydroxyethyl)-1'-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1S)-2-(2-hydroxyethyl)-1'-methy…

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Vendors

And 12 More

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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)	1.51	-0.49	-17.45	1	7	0	91	376.368	2	↓ MOL2 SDF SMILES Flexibase

More about ZINC02210847

2210849

Analogs

2390578
2390580
16742334
16742335
33699650

Popular Name: (1R)-2-(2-hydroxyethyl)-1'-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-(2-hydroxyethyl)-1'-methy…

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Vendors

And 12 More

Draw Identity 99% 90% 80% 70%

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)	1.51	5.14	-19.65	1	7	0	91	376.368	2	↓ MOL2 SDF SMILES Flexibase

More about ZINC02210849

2201339

Analogs

2390578
2390580
2408695
16742334
16742335

Popular Name: (1R)-1'-ethyl-2-(2-methoxyethyl)spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-1'-ethyl-2-(2-methoxyethyl)…

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Vendors

And 10 More

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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)	2.50	8.44	-18.91	0	7	0	80	404.422	4	↓ MOL2 SDF SMILES Flexibase

More about ZINC02201339

2123338

Analogs

2390578
2390580
2408695
16742334
16742335

Popular Name: (1R)-2-(2-methoxyethyl)-1'-methyl-spiro[chromeno[2,3-c]pyrrole-1,3'-indoline]-2',3,9-trione (1R)-2-(2-methoxyethyl)-1'-methy…

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Vendors

And 7 More

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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)	2.13	1.82	-16.64	0	7	0	80	390.395	3	↓ MOL2 SDF SMILES Flexibase

More about ZINC02123338

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