In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 29 | No |
Popular Name: N-[[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-N'-(3-fluorophenyl)oxamide N-[[4-[(4-ethylpiperazin-1-yl)me…
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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) | 1.83 | 6.96 | -37.98 | 3 | 6 | 1 | 66 | 399.49 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 6.94 | -41.81 | 3 | 6 | 1 | 66 | 399.49 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 4.68 | -8.34 | 2 | 6 | 0 | 65 | 398.482 | 7 | ↓ |