In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2008 | 23 | Yes |
Popular Name: (4-benzylpiperazin-1-yl)-(2,6-dichloro-4-pyridyl)methanone (4-benzylpiperazin-1-yl)-(2,6-di…
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) | 2.94 | 6.73 | -7.19 | 0 | 4 | 0 | 36 | 350.249 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.94 | 8.93 | -49.64 | 1 | 4 | 1 | 38 | 351.257 | 3 | ↓ |