In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2008 | 30 | Yes |
Popular Name: 3,4-dimethoxy-N-[2-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]amino]-2-oxo-ethyl]benzamide 3,4-dimethoxy-N-[2-[[6-(4-methyl…
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) | 1.21 | 4.8 | -49.78 | 3 | 9 | 1 | 97 | 414.486 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 2.33 | -16.41 | 2 | 9 | 0 | 96 | 413.478 | 7 | ↓ |