In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 28 | Yes |
Popular Name: [3-(4-fluoro-3-methyl-phenyl)-1H-pyrazol-5-yl]-[4-(morpholinomethyl)-1-piperidyl]methanone [3-(4-fluoro-3-methyl-phenyl)-1H…
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) | 2.86 | 6.96 | -10.36 | 1 | 6 | 0 | 61 | 386.471 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.86 | 8.96 | -49.57 | 2 | 6 | 1 | 63 | 387.479 | 4 | ↓ |