UCSF

ZINC06498568

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2006 31 No

Popular Name: 3-hydroxy-5-(4-hydroxy-3-methoxy-phenyl)-4-(4-methoxybenzoyl)-1-(3-methoxypropyl)-5H-pyrrol-2-one 3-hydroxy-5-(4-hydroxy-3-methoxy…

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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) 2.03 4.31 -60.78 1 8 -1 108 426.445 9 ↓
Lo Low (pH 4.5-6) 2.03 3.56 -17.54 2 8 0 106 427.453 9 ↓

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