In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2008 | 30 | Yes |
Popular Name: 4-bromo-N-[(1S)-2-methyl-1-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]carbamoyl]propyl]benzamide 4-bromo-N-[(1S)-2-methyl-1-[[6-(…
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) | 3.12 | 8.68 | -44.65 | 3 | 7 | 1 | 79 | 475.411 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 6.21 | -10.77 | 2 | 7 | 0 | 78 | 474.403 | 6 | ↓ |