UCSF

ZINC04954303

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2006 29 No

Popular Name: 1-(2-dimethylaminoethyl)-4-(2,5-dimethylbenzoyl)-3-hydroxy-5-(4-hydroxyphenyl)-5H-pyrrol-2-one 1-(2-dimethylaminoethyl)-4-(2,5-…

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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) 2.75 -0.14 -49.57 3 6 1 82 395.479 6 ↓
Mid Mid (pH 6-8) 3.20 -0.57 -61.89 3 6 1 82 395.479 5 ↓
Mid Mid (pH 6-8) 2.17 -0.31 -59.3 2 6 1 79 395.479 6 ↓

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