In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 26 | Yes |
Popular Name: [4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)piperazin-1-yl]-(o-tolyl)methanone [4-(5-isopropyl-2,6-dimethyl-pyr…
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) | 2.59 | 11.2 | -37.43 | 1 | 5 | 1 | 51 | 353.49 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 10.81 | -10.75 | 0 | 5 | 0 | 49 | 352.482 | 3 | ↓ |