In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 34 | Yes |
Popular Name: 2-(2,4-difluorophenyl)-4-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]quinazoline 2-(2,4-difluorophenyl)-4-[4-[5-(…
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) | 5.72 | 12.3 | -10.25 | 0 | 5 | 0 | 45 | 471.433 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.72 | 12.61 | -35.46 | 1 | 5 | 1 | 46 | 472.441 | 4 | ↓ |