| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2005 | 22 | Yes |
Popular Name: 4-piperazin-1-yl-2-[2-(trifluoromethyl)phenyl]-pyrimidine 4-piperazin-1-yl-2-[2-(trifluoro…
| 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) | 2.50 | 9.01 | -50.92 | 2 | 4 | 1 | 46 | 309.315 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 7.68 | -9.16 | 1 | 4 | 0 | 41 | 308.307 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.50 | 9 | -91.18 | 3 | 4 | 2 | 47 | 310.323 | 3 | ↓ |
