| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 13th, 2009 | 33 | No |
Popular Name: [4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)piperazin-1-yl]-(4-nitrophenyl)methanone [4-(5-isopropyl-6-methyl-2-pheny…
| 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) | 4.17 | 13.91 | -12.58 | 0 | 8 | 0 | 95 | 445.523 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.17 | 14.23 | -37.5 | 1 | 8 | 1 | 96 | 446.531 | 5 | ↓ |
