UCSF

ZINC09233722

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 36 No

Popular Name: 4-[[2-(4-fluorophenyl)-4,5-dioxo-1-[2-(1-piperidyl)ethyl]pyrrolidin-3-ylidene]-hydroxy-methyl]-N,N-d 4-[[2-(4-fluorophenyl)-4,5-dioxo…

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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) 2.79 9.45 -66.17 1 8 0 102 515.607 8 ↓
Hi High (pH 8-9.5) 2.79 7.16 -56.42 0 8 -1 101 514.599 8 ↓
Mid Mid (pH 6-8) 2.21 -2.83 -55.04 1 8 1 96 516.615 8 ↓

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