In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 24 | Yes |
Popular Name: 2-[(3R,4S)-1-(isopropylcarbamoyl)-3-[2-(1-piperidyl)ethyl]-4-piperidyl]acetic 2-[(3R,4S)-1-(isopropylcarbamoyl…
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) | 2.82 | 9.13 | -57.22 | 2 | 6 | 0 | 77 | 339.48 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.82 | 8 | -40.44 | 3 | 6 | 1 | 74 | 340.488 | 6 | ↓ |