In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2008 | 23 | Yes |
Popular Name: 1-[(2-fluorophenyl)methyl]-N-(3-pyridyl)piperidine-4-carboxamide 1-[(2-fluorophenyl)methyl]-N-(3-…
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) | 2.36 | 8.4 | -46.06 | 2 | 4 | 1 | 46 | 314.384 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.36 | 8.69 | -88.01 | 3 | 4 | 2 | 48 | 315.392 | 4 | ↓ |