UCSF

ZINC12574666

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 18th, 2008 34 No

Popular Name: (5S)-4-(4-chlorobenzoyl)-5-(2,3-dimethoxyphenyl)-3-hydroxy-1-(2-morpholinoethyl)-5H-pyrrol-2-one (5S)-4-(4-chlorobenzoyl)-5-(2,3-…

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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 6.92 -57.46 0 8 -1 91 485.944 8 ↓
Mid Mid (pH 6-8) 3.20 8.17 -60.34 2 8 1 90 487.96 7 ↓
Mid Mid (pH 6-8) 2.75 9.26 -74.4 1 8 0 93 486.952 8 ↓

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