| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 19 | Yes |
Popular Name: (1S,2R)-2-(2-isopropylimidazol-1-yl)-1-phenyl-butan-1-amine (1S,2R)-2-(2-isopropylimidazol-1…
| 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) | 1.12 | 8.47 | -107.12 | 4 | 3 | 2 | 47 | 259.397 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 7.78 | -5.1 | 2 | 3 | 0 | 44 | 257.381 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 8.03 | -51.87 | 3 | 3 | 1 | 45 | 258.389 | 5 | ↓ |
