UCSF

ZINC09380314

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2007 32 No

Popular Name: 5-(4-ethoxyphenyl)-3-hydroxy-4-(4-methoxy-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) 3.50 8.58 -60.79 0 7 -1 88 438.5 10 ↓
Mid Mid (pH 6-8) 3.95 7.13 -28.65 1 7 0 85 439.508 9 ↓
Mid Mid (pH 6-8) 2.92 8.1 -24.73 0 7 0 82 439.508 10 ↓

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