In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 32 | Yes |
Popular Name: 2-(3-pyridyl)-4-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]quinazoline 2-(3-pyridyl)-4-[4-[5-(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) | 4.40 | 10.18 | -11.18 | 0 | 6 | 0 | 58 | 436.441 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.40 | 10.5 | -34.51 | 1 | 6 | 1 | 59 | 437.449 | 4 | ↓ |