In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 26 | Yes |
Popular Name: (4-methyl-1-piperidyl)-[2-[(2S)-2-phenylpyrrolidin-1-yl]-3-pyridyl]methanone (4-methyl-1-piperidyl)-[2-[(2S)-…
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) | 3.19 | 12.39 | -9.68 | 0 | 4 | 0 | 36 | 349.478 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.19 | 12.82 | -35.28 | 1 | 4 | 1 | 38 | 350.486 | 3 | ↓ |