UCSF

ZINC09506909

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2007 35 No

Popular Name: 5-(4-chlorophenyl)-3-hydroxy-1-(2-methoxyethyl)-4-[4-(m-tolylmethoxy)benzoyl]-5H-pyrrol-2-one 5-(4-chlorophenyl)-3-hydroxy-1-(…

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Download: MOL2 SDF SMILES Flexibase

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) 5.12 12.16 -40.75 0 6 -1 79 490.963 9 ↓
Mid Mid (pH 6-8) 5.56 11.14 -26.98 1 6 0 76 491.971 8 ↓
Mid Mid (pH 6-8) 4.53 12.18 -17.92 0 6 0 73 491.971 9 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )