| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 16 | Yes |
Popular Name: (1R)-1-[3-chloro-4-(2-methylimidazol-1-yl)phenyl]ethanamine (1R)-1-[3-chloro-4-(2-methylimid…
| 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) | 0.04 | 6.04 | -55.01 | 3 | 3 | 1 | 45 | 236.726 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.04 | 5.74 | -6.64 | 2 | 3 | 0 | 44 | 235.718 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.04 | 6.5 | -86.54 | 4 | 3 | 2 | 47 | 237.734 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
