UCSF

ZINC04756265

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 31 No

Popular Name: 1-(2-dimethylaminoethyl)-4-(4-ethoxy-2-methyl-benzoyl)-5-(2-fluorophenyl)-3-hydroxy-5H-pyrrol-2-one 1-(2-dimethylaminoethyl)-4-(4-et…

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Vendors

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) 3.33 2.32 -45.24 2 6 1 71 427.496 8 ↓
Mid Mid (pH 6-8) 3.78 2.36 -52.35 2 6 1 71 427.496 7 ↓
Mid Mid (pH 6-8) 2.75 2.07 -49.48 1 6 1 68 427.496 8 ↓

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