In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2009 | 25 | Yes |
Popular Name: [4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-(6-methyl-3-pyridyl)methanone [4-(2-isopropyl-6-methyl-pyrimid…
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) | 1.09 | 7.48 | -36.13 | 1 | 6 | 1 | 63 | 340.451 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 7.1 | -10.95 | 0 | 6 | 0 | 62 | 339.443 | 3 | ↓ |