In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 23 | Yes |
Popular Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-pentylsulfanyl-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) | 1.76 | 4.01 | -11.86 | 1 | 5 | 0 | 57 | 337.489 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 6.3 | -43.51 | 2 | 5 | 1 | 58 | 338.497 | 8 | ↓ |