| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 17 | Yes |
Popular Name: (1S,2S)-2-(2-methylimidazol-1-yl)-1-phenyl-butan-1-amine (1S,2S)-2-(2-methylimidazol-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) | 0.06 | 7.76 | -109.03 | 4 | 3 | 2 | 47 | 231.343 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.06 | 7.01 | -4.98 | 2 | 3 | 0 | 44 | 229.327 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.06 | 7.32 | -49.37 | 3 | 3 | 1 | 45 | 230.335 | 4 | ↓ |
