In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 27 | Yes |
Popular Name: N-(p-tolyl)-6-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide N-(p-tolyl)-6-[(2R)-2-(3-pyridyl…
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) | 3.23 | 10.2 | -13.06 | 1 | 5 | 0 | 58 | 358.445 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 10.72 | -36.22 | 2 | 5 | 1 | 59 | 359.453 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 11.16 | -94.51 | 3 | 5 | 2 | 61 | 360.461 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 10.62 | -43.3 | 2 | 5 | 1 | 59 | 359.453 | 4 | ↓ |