UCSF

ZINC09375176

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2007 35 No

Popular Name: 5-(4-ethoxyphenyl)-3-hydroxy-4-(4-isobutoxy-3-methyl-benzoyl)-1-(3-methoxypropyl)-5H-pyrrol-2-one 5-(4-ethoxyphenyl)-3-hydroxy-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) 4.62 11.77 -55.48 0 7 -1 88 480.581 12 ↓
Mid Mid (pH 6-8) 5.07 9.97 -27.13 1 7 0 85 481.589 11 ↓
Mid Mid (pH 6-8) 4.04 10.94 -21.21 0 7 0 82 481.589 12 ↓

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