In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2011 | 20 | Yes |
Popular Name: N-(4-cyanophenyl)-2-(3,3-dimethyl-1-piperidyl)acetamide N-(4-cyanophenyl)-2-(3,3-dimethy…
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) | 2.83 | 8.3 | -46.45 | 2 | 4 | 1 | 57 | 272.372 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 7.47 | -28.37 | 1 | 4 | 0 | 64 | 271.364 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 5.55 | -35.56 | 0 | 4 | -1 | 62 | 270.356 | 3 | ↓ |