User Information

• Synonyms (0)
• Vendors (11)
• Annotations (2)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (7)

ZINC04318711

• 4318711

Physical Representations

Activity (Go SEA)

• 4318713
  

  Analogs

  33758610

  

  33758611

  

  39910306

  

  39910307

  

  40042471

  

  Popular Name: (3-chlorophenyl)-(2-hydroxyethyl)BLAHdione (3-chlorophenyl)-(2-hydroxyethyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK706139

  • eMolecules

    • 4659910

  • Enamine

    • Z57789160

  • IBScreen

    • STOCK5S-18703

  • Innovapharm

    • STT-00105486

  And 9 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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	2.86	-0.78	-13.19	1	5	0	70	355.777	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC04318713
• 33758610
  

  Analogs

  4318711

  

  Popular Name: (1R)-1-(3-chlorophenyl)-2-(2-hydroxyethyl)-7-methyl-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-1-(3-chlorophenyl)-2-(2-hyd…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 4804212

  • PubChem

    • 5160955

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	3.28	7.21	-13.88	1	5	0	71	369.804	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33758610
• 33758611
  

  Analogs

  4318711

  

  Popular Name: (1S)-1-(3-chlorophenyl)-2-(2-hydroxyethyl)-7-methyl-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-1-(3-chlorophenyl)-2-(2-hyd…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 4804212

  • PubChem

    • 5160955

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	3.28	7.57	-13.73	1	5	0	71	369.804	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33758611
• 39910306
  

  Analogs

  16751331

  

  Popular Name: (1R)-1-(3-chlorophenyl)-2-(2-methoxyethyl)-5,7-dimethyl-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-1-(3-chlorophenyl)-2-(2-met…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm Make-on-Demand

    • VT-00222710

  • PubChem

    • 18880623

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	4.28	10.63	-9.76	0	5	0	60	397.858	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC39910306
• 39910307
  

  Analogs

  16751331

  

  Popular Name: (1S)-1-(3-chlorophenyl)-2-(2-methoxyethyl)-5,7-dimethyl-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-1-(3-chlorophenyl)-2-(2-met…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm Make-on-Demand

    • VT-00222710

  • PubChem

    • 18880623

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	4.28	10.47	-11.66	0	5	0	60	397.858	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC39910307
• 40042471
  

  Analogs

  4318711

  

  Popular Name: (1R)-1-(3-chlorophenyl)-7-ethyl-2-(2-hydroxyethyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-1-(3-chlorophenyl)-7-ethyl-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 44844566

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	3.75	8.29	-10.36	1	5	0	71	383.831	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC40042471
• 40042472
  

  Analogs

  4318711

  

  Popular Name: (1S)-1-(3-chlorophenyl)-7-ethyl-2-(2-hydroxyethyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-1-(3-chlorophenyl)-7-ethyl-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 44844566

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	3.75	8.14	-12.38	1	5	0	71	383.831	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC40042472