In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 28 | Yes |
Popular Name: 2-[(3R,4S)-3-[2-(4-carbamoyl-1-piperidyl)ethyl]-1-(cyclopentanecarbonyl)-4-piperidyl]acetic 2-[(3R,4S)-3-[2-(4-carbamoyl-1-p…
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) | 1.64 | 7.58 | -68.44 | 3 | 7 | 0 | 108 | 393.528 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.64 | 6.45 | -53.27 | 4 | 7 | 1 | 105 | 394.536 | 7 | ↓ |