In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 24 | Yes |
Popular Name: (2S)-2-(4-chlorophenyl)-1-[(3S)-3-methyl-1-piperidyl]-3-(4-pyridyl)propan-1-one (2S)-2-(4-chlorophenyl)-1-[(3S)-…
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) | 4.07 | 10.75 | -9.96 | 0 | 3 | 0 | 33 | 342.87 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.07 | 11.24 | -40.79 | 1 | 3 | 1 | 34 | 343.878 | 4 | ↓ |