In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 24 | Yes |
Popular Name: N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]-3-phenyl-propanamide N-[6-(4-methylpiperazin-1-yl)-3-…
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) | 2.70 | 8.56 | -42.82 | 2 | 5 | 1 | 50 | 325.436 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 6.09 | -10.9 | 1 | 5 | 0 | 48 | 324.428 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 6.38 | -38.09 | 2 | 5 | 1 | 50 | 325.436 | 5 | ↓ |