In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2007 | 23 | Yes |
Popular Name: N-(2,4-difluorophenyl)-8-isobutyl-2,4,8-triazabicyclo[4.4.0]deca-1,3,5-trien-3-amine N-(2,4-difluorophenyl)-8-isobuty…
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) | 3.77 | 11.54 | -44.32 | 2 | 4 | 1 | 42 | 319.379 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.77 | 9.55 | -5.33 | 1 | 4 | 0 | 41 | 318.371 | 4 | ↓ |