In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 31 | Yes |
Popular Name: N-(1-adamantylmethyl)-2-[(2S)-2-phenylpyrrolidin-1-yl]pyridine-3-carboxamide N-(1-adamantylmethyl)-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) | 5.21 | 14.65 | -8.31 | 1 | 4 | 0 | 45 | 415.581 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.21 | 15.02 | -34.94 | 2 | 4 | 1 | 46 | 416.589 | 5 | ↓ |