UCSF

ZINC06239972

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2006 27 No

Popular Name: 4-[(4-bromophenyl)-hydroxy-methylene]-1-(2-hydroxyethyl)-5-(4-methoxyphenyl)-pyrrolidine-2,3-dione 4-[(4-bromophenyl)-hydroxy-methy…

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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) 2.61 5.17 -57.3 1 6 -1 90 431.262 6 ↓
Mid Mid (pH 6-8) 2.61 -3.1 -13.64 2 6 0 87 432.27 6 ↓
Mid Mid (pH 6-8) 2.03 -3.24 -14.17 1 6 0 83 432.27 6 ↓

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