In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 25 | Yes |
Popular Name: [2-[(3R)-3-methylpiperazin-1-yl]-3-pyridyl]-[(5S)-3,3,5-trimethylazepan-1-yl]methanone [2-[(3R)-3-methylpiperazin-1-yl]…
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) | 2.34 | 8.93 | -37.2 | 2 | 5 | 1 | 53 | 345.511 | 2 | ↓ |