| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 18 | Yes |
Popular Name: 1-[3-(imidazol-1-ylmethyl)benzothiophen-2-yl]-N-methyl-methanamine 1-[3-(imidazol-1-ylmethyl)benzot…
| 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) | 2.28 | 9.35 | -102.53 | 3 | 3 | 2 | 36 | 259.378 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.28 | 7.39 | -8.05 | 1 | 3 | 0 | 30 | 257.362 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 8.84 | -52.92 | 2 | 3 | 1 | 34 | 258.37 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
