In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2009 | 25 | Yes |
Popular Name: (3S)-1-(4-methylbenzoyl)-N-(3-pyridylmethyl)piperidine-3-carboxamide (3S)-1-(4-methylbenzoyl)-N-(3-py…
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) | 1.39 | 7.28 | -12.05 | 1 | 5 | 0 | 62 | 337.423 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.39 | 7.75 | -40.51 | 2 | 5 | 1 | 64 | 338.431 | 4 | ↓ |