In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 25 | Yes |
Popular Name: N-(2,2-dimethylpropyl)-2-[(2S)-2-(3-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide N-(2,2-dimethylpropyl)-2-[(2S)-2…
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) | 2.74 | 9.74 | -10.19 | 1 | 5 | 0 | 58 | 338.455 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.74 | 10.22 | -33.43 | 2 | 5 | 1 | 59 | 339.463 | 5 | ↓ |