In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2008 | 17 | Yes |
Popular Name: (1S,2S)-1-(4-fluorophenyl)-2-(2-methylimidazol-1-yl)propan-1-amine (1S,2S)-1-(4-fluorophenyl)-2-(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) | -0.28 | 6.82 | -116.3 | 4 | 3 | 2 | 47 | 235.306 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.28 | 6.12 | -6.32 | 2 | 3 | 0 | 44 | 233.29 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.28 | 6.39 | -55.9 | 3 | 3 | 1 | 45 | 234.298 | 3 | ↓ |