In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 17 | Yes |
Popular Name: 2-[1-[(2,4-difluorophenyl)methyl]imidazol-2-yl]ethanamine 2-[1-[(2,4-difluorophenyl)methyl…
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) | 0.93 | 5.38 | -61.26 | 3 | 3 | 1 | 45 | 238.261 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 4.98 | -9.6 | 2 | 3 | 0 | 44 | 237.253 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.93 | 5.94 | -117.96 | 4 | 3 | 2 | 47 | 239.269 | 4 | ↓ |