In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 18 | Yes |
Popular Name: 2-[(3S,5R)-3,5-dimethyl-1-piperidyl]-1-(p-tolyl)ethanone 2-[(3S,5R)-3,5-dimethyl-1-piperi…
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) | 3.56 | 10.19 | -38.24 | 1 | 2 | 1 | 22 | 246.374 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.56 | 8.01 | -6.57 | 0 | 2 | 0 | 20 | 245.366 | 3 | ↓ |