In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 22nd, 2009 | 23 | Yes |
Popular Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(2-chloro-4-pyridyl)methanone [4-[(3-chlorophenyl)methyl]piper…
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) | 2.58 | 6.81 | -10.84 | 0 | 4 | 0 | 36 | 350.249 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.58 | 9.03 | -55.46 | 1 | 4 | 1 | 38 | 351.257 | 3 | ↓ |