In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 29th, 2008 | 34 | Yes |
Popular Name: [4-(2-benzhydryloxyethyl)piperazin-1-yl]-(2-propylsulfanyl-3-pyridyl)methanone [4-(2-benzhydryloxyethyl)piperaz…
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) | 4.49 | 12.76 | -12.67 | 0 | 5 | 0 | 46 | 475.658 | 10 | ↓ |
Lo Low (pH 4.5-6) | 4.49 | 15.03 | -48.63 | 1 | 5 | 1 | 47 | 476.666 | 10 | ↓ |