In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 16 | Yes |
Popular Name: 1-[[1-(difluoromethyl)imidazol-2-yl]methyl]-1,4-diazepane 1-[[1-(difluoromethyl)imidazol-2…
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) | 0.03 | 3.18 | -40.76 | 2 | 4 | 1 | 38 | 231.27 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.03 | 3.87 | -85.3 | 3 | 4 | 2 | 39 | 232.278 | 3 | ↓ |