In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 29 | Yes |
Popular Name: 2-[(3R,4S)-1-benzoyl-3-[2-(4-carbamoyl-1-piperidyl)ethyl]-4-piperidyl]acetic 2-[(3R,4S)-1-benzoyl-3-[2-(4-car…
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) | 1.10 | 7.98 | -69.54 | 3 | 7 | 0 | 108 | 401.507 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.10 | 6.85 | -55.08 | 4 | 7 | 1 | 105 | 402.515 | 7 | ↓ |