In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 24 | Yes |
Popular Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone [4-(2-hydroxyethyl)piperazin-1-y…
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) | 1.35 | 3.86 | -13.72 | 1 | 5 | 0 | 57 | 343.452 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.35 | 6.16 | -45.65 | 2 | 5 | 1 | 58 | 344.46 | 5 | ↓ |