In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 31 | Yes |
Popular Name: 4-(5-benzyl-6-methyl-2-phenyl-pyrimidin-4-yl)-N-ethyl-piperazine-1-carboxamide 4-(5-benzyl-6-methyl-2-phenyl-py…
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) | 5.15 | 12.45 | -13.19 | 1 | 6 | 0 | 61 | 415.541 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.15 | 12.77 | -38.25 | 2 | 6 | 1 | 63 | 416.549 | 5 | ↓ |