| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 18 | Yes |
Popular Name: 4-[2-[(1S)-1-aminobutyl]-1H-imidazol-5-yl]benzonitrile 4-[2-[(1S)-1-aminobutyl]-1H-imid…
| 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) | 0.39 | 5.55 | -58.07 | 4 | 4 | 1 | 80 | 241.318 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 5.22 | -9.15 | 3 | 4 | 0 | 78 | 240.31 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.39 | 5.92 | -131.45 | 5 | 4 | 2 | 81 | 242.326 | 4 | ↓ |
