In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 28 | Yes |
Popular Name: N,N-diisobutyl-6-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide N,N-diisobutyl-6-[(2R)-2-(3-pyri…
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) | 3.10 | 11.51 | -11.03 | 0 | 5 | 0 | 49 | 380.536 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 11.9 | -42.14 | 1 | 5 | 1 | 51 | 381.544 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 12.12 | -34.75 | 1 | 5 | 1 | 51 | 381.544 | 7 | ↓ |