UCSF

ZINC08384184

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2006 34 No

Popular Name: 4-(4-ethoxybenzoyl)-3-hydroxy-5-[3-(isopentyloxy)phenyl]-1-(2-methoxyethyl)-1,5-dihydro-2H-pyrrol-2-one 4-(4-ethoxybenzoyl)-3-hydroxy-5-…

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Other Names:

MFCD04088687

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) 4.48 9.76 -61.22 0 7 -1 88 466.554 12 ↓
Mid Mid (pH 6-8) 3.90 0.01 -22.97 0 7 0 82 467.562 12 ↓
Mid Mid (pH 6-8) 4.93 -0.24 -27.35 1 7 0 85 467.562 11 ↓

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