In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 11th, 2008 | 29 | Yes |
Popular Name: N-[(1S)-2-methyl-1-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]carbamoyl]propyl]benzamide N-[(1S)-2-methyl-1-[[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) | 2.31 | 7.9 | -45.31 | 3 | 7 | 1 | 79 | 396.515 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 5.43 | -11.61 | 2 | 7 | 0 | 78 | 395.507 | 6 | ↓ |