In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 30 | Yes |
Popular Name: 2-[(3R,4S)-3-[2-(1-piperidyl)ethyl]-1-[4-(trifluoromethyl)benzoyl]-4-piperidyl]acetic 2-[(3R,4S)-3-[2-(1-piperidyl)eth…
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) | 3.40 | 12.31 | -59.9 | 1 | 5 | 0 | 65 | 426.479 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.40 | 11.18 | -43.25 | 2 | 5 | 1 | 62 | 427.487 | 7 | ↓ |