In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 21 | Yes |
Popular Name: [2-[4-(4-fluorophenyl)piperazin-1-yl]-3-pyridyl]methanamine [2-[4-(4-fluorophenyl)piperazin-…
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) | 2.03 | 4.69 | -50.83 | 3 | 4 | 1 | 47 | 287.362 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 5.11 | -109.42 | 4 | 4 | 2 | 48 | 288.37 | 3 | ↓ |