In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2011 | 24 | Yes |
Popular Name: [4-(5-bromo-2-pyridyl)piperazin-1-yl]-[2-(dimethylamino)-3-pyridyl]methanone [4-(5-bromo-2-pyridyl)piperazin-…
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) | 1.73 | 9.12 | -10.12 | 0 | 6 | 0 | 53 | 390.285 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.73 | 9.07 | -42.49 | 1 | 6 | 1 | 54 | 391.293 | 3 | ↓ |