UCSF

ZINC09969641

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2007 29 No

Popular Name: 5-(3-chlorophenyl)-4-(3-fluoro-4-methoxy-benzoyl)-3-hydroxy-1-(3-hydroxypropyl)-5H-pyrrol-2-one 5-(3-chlorophenyl)-4-(3-fluoro-4…

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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) 2.82 5.76 -56.13 1 6 -1 90 418.828 7 ↓
Mid Mid (pH 6-8) 3.27 4.74 -31.66 2 6 0 87 419.836 6 ↓
Mid Mid (pH 6-8) 2.24 5.76 -25.23 1 6 0 84 419.836 7 ↓

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