In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 21 | Yes |
Popular Name: 2-[(3-chlorophenyl)methyl]-6-(4-piperidyl)-3H-pyrimidin-4-one 2-[(3-chlorophenyl)methyl]-6-(4-…
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) | 2.44 | 7.17 | -50.55 | 3 | 4 | 1 | 62 | 304.801 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 6.06 | -68.33 | 2 | 4 | 0 | 65 | 303.793 | 3 | ↓ |