UCSF

ZINC55532994

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2010 29 Yes

Popular Name: 1-(2,4-dimethoxyphenyl)-3-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]urea 1-(2,4-dimethoxyphenyl)-3-[2-[4-…

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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) 3.22 5.06 -11.49 2 7 0 66 402.47 7 ↓
Hi High (pH 8-9.5) 2.85 2.59 -13.31 2 7 0 70 402.47 8 ↓
Mid Mid (pH 6-8) 2.85 5.89 -113.96 4 7 2 72 404.486 8 ↓

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