UCSF

ZINC11915279

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2008 28 No

Popular Name: (5R)-3-hydroxy-5-(3-hydroxyphenyl)-4-(4-isobutoxybenzoyl)-1-methyl-5H-pyrrol-2-one (5R)-3-hydroxy-5-(3-hydroxypheny…

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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) 3.05 -1.34 -13.05 2 6 0 87 381.428 6 ↓
Mid Mid (pH 6-8) 2.47 -1.43 -20.41 1 6 0 84 381.428 6 ↓

Activity (Go SEA)

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