In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 18 | Yes |
Popular Name: (1R,2R)-1-(2-ethylimidazol-1-yl)-1-(4-fluorophenyl)propan-2-amine (1R,2R)-1-(2-ethylimidazol-1-yl)…
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) | 1.61 | 7.06 | -110.55 | 4 | 3 | 2 | 47 | 249.333 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 6.28 | -6.39 | 2 | 3 | 0 | 44 | 247.317 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 6.64 | -53.3 | 3 | 3 | 1 | 45 | 248.325 | 4 | ↓ |