UCSF

ZINC41588040

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 29 No

Popular Name: N-[[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-N'-(2-fluorophenyl)oxamide N-[[4-[(4-ethylpiperazin-1-yl)me…

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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) 1.81 7 -37.93 3 6 1 66 399.49 7 ↓
Mid Mid (pH 6-8) 1.81 6.98 -41.42 3 6 1 66 399.49 7 ↓
Mid Mid (pH 6-8) 1.81 4.72 -6.86 2 6 0 65 398.482 7 ↓

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