In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2010 | 21 | Yes |
Popular Name: 1-(2-cyanoethyl)-N-cyclooctyl-piperidine-4-carboxamide 1-(2-cyanoethyl)-N-cyclooctyl-pi…
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) | 2.60 | 8.43 | -55.08 | 2 | 4 | 1 | 57 | 292.447 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 6.17 | -10.95 | 1 | 4 | 0 | 56 | 291.439 | 4 | ↓ |