UCSF

ZINC05409201

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2006 30 No

Popular Name: 5-(4-fluorophenyl)-4-[(4-fluorophenyl)-hydroxy-methylene]-1-(3-pyridylmethyl)pyrrolidine-2,3-dione 5-(4-fluorophenyl)-4-[(4-fluorop…

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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) 2.87 9.05 -57.34 0 5 -1 73 405.38 5 ↓
Lo Low (pH 4.5-6) 3.31 9.47 -47.31 2 5 1 72 407.396 4 ↓
Lo Low (pH 4.5-6) 2.87 8.24 -17.88 1 5 0 71 406.388 5 ↓

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