In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2008 | 28 | No |
Popular Name: 3-[(3R)-1-(cyclohexene-1-carbonyl)-3-piperidyl]-N-methyl-N-[2-(2-pyridyl)ethyl]propanamide 3-[(3R)-1-(cyclohexene-1-carbony…
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) | 3.07 | 11.29 | -15.46 | 0 | 5 | 0 | 54 | 383.536 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.07 | 11.56 | -35.4 | 1 | 5 | 1 | 55 | 384.544 | 7 | ↓ |