In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 29 | Yes |
Popular Name: N-[3-(hydroxymethyl)-2-methyl-phenyl]-2-[(2R)-2-phenylpyrrolidin-1-yl]pyridine-3-carboxamide N-[3-(hydroxymethyl)-2-methyl-ph…
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) | 3.66 | 10.51 | -12.48 | 2 | 5 | 0 | 65 | 387.483 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.66 | 10.97 | -39.73 | 3 | 5 | 1 | 67 | 388.491 | 5 | ↓ |