In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 30 | Yes |
Popular Name: N-(4-phenylbutyl)-6-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide N-(4-phenylbutyl)-6-[(2R)-2-(3-p…
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) | 3.68 | 11.97 | -13.91 | 1 | 5 | 0 | 58 | 400.526 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.68 | 12.41 | -43.95 | 2 | 5 | 1 | 59 | 401.534 | 8 | ↓ |