| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 18 | Yes |
Popular Name: [(1R,3S)-1-[(1-ethylimidazol-2-yl)methylamino]-3-methyl-cyclohexyl]methanol [(1R,3S)-1-[(1-ethylimidazol-2-y…
| 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) | 1.38 | 4.05 | -28.05 | 3 | 4 | 1 | 51 | 252.382 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 3.32 | -9.14 | 2 | 4 | 0 | 50 | 251.374 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 4.53 | -36.67 | 3 | 4 | 1 | 55 | 252.382 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 5.04 | -100.46 | 4 | 4 | 2 | 56 | 253.39 | 5 | ↓ |
