In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 27 | Yes |
Popular Name: 2-[(2S)-2-phenylpyrrolidin-1-yl]-N-(3-pyridylmethyl)pyridine-3-carboxamide 2-[(2S)-2-phenylpyrrolidin-1-yl]…
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) | 2.43 | 10.64 | -10.33 | 1 | 5 | 0 | 58 | 358.445 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.43 | 11.11 | -43.66 | 2 | 5 | 1 | 59 | 359.453 | 5 | ↓ |