In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 30 | Yes |
Popular Name: 2-[(3R,4S)-3-[2-(4-carbamoyl-1-piperidyl)ethyl]-1-(4-fluorobenzoyl)-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) | 1.26 | 8.03 | -69.54 | 3 | 7 | 0 | 108 | 419.497 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.26 | 6.9 | -55.49 | 4 | 7 | 1 | 105 | 420.505 | 7 | ↓ |