| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 18 | Yes |
Popular Name: 1-[[[(1R)-2-imidazol-1-yl-1-methyl-ethyl]amino]methyl]cycloheptanol 1-[[[(1R)-2-imidazol-1-yl-1-meth…
| 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) | 1.96 | 6.16 | -45.41 | 3 | 4 | 1 | 55 | 252.382 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.96 | 5.52 | -6.63 | 2 | 4 | 0 | 50 | 251.374 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.96 | 6.68 | -106.19 | 4 | 4 | 2 | 56 | 253.39 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
