UCSF

ZINC05920825

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 32 No

Popular Name: 4-(4-ethoxy-3-methylbenzoyl)-1-(3-ethoxypropyl)-3-hydroxy-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one 4-(4-ethoxy-3-methylbenzoyl)-1-(…

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Other Names:

MFCD03861373

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) 4.27 11.31 -43.22 0 6 -1 79 436.528 10 ↓
Mid Mid (pH 6-8) 4.71 0.3 -26.79 1 6 0 76 437.536 9 ↓
Mid Mid (pH 6-8) 3.68 0.51 -18.67 0 6 0 72 437.536 10 ↓

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