In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2008 | 21 | Yes |
Popular Name: 2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-6-phenyl-3H-pyrimidin-4-one 2-[(3S,5S)-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) | 3.94 | 9.28 | -8.95 | 1 | 4 | 0 | 49 | 283.375 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.39 | 8.33 | -48.67 | 0 | 4 | -1 | 52 | 282.367 | 2 | ↓ |