In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 27 | Yes |
Popular Name: 3-[3-(4-fluorophenyl)-4-(1-piperidyl)isoxazolo[4,5-e]pyrimidin-6-yl]propanoic 3-[3-(4-fluorophenyl)-4-(1-piper…
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) | 2.89 | 9.11 | -47.95 | 0 | 7 | -1 | 95 | 369.376 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.89 | 7.13 | -9.84 | 1 | 7 | 0 | 92 | 370.384 | 5 | ↓ |