In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 23 | Yes |
Popular Name: (4-benzylpiperazin-1-yl)-(2,4-dimethylpyrimidin-5-yl)methanone (4-benzylpiperazin-1-yl)-(2,4-di…
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) | 0.56 | 6.16 | -7.95 | 0 | 5 | 0 | 49 | 310.401 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.56 | 8.37 | -47.76 | 1 | 5 | 1 | 51 | 311.409 | 3 | ↓ |