In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | Yes |
Popular Name: (1R,2R)-1-(4-fluorophenyl)-1-(2-isopropylimidazol-1-yl)propan-2-amine (1R,2R)-1-(4-fluorophenyl)-1-(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) | 2.09 | 7.64 | -110.86 | 4 | 3 | 2 | 47 | 263.36 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.09 | 6.67 | -6.04 | 2 | 3 | 0 | 44 | 261.344 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 7 | -53.4 | 3 | 3 | 1 | 45 | 262.352 | 4 | ↓ |