| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 19 | Yes |
Popular Name: N-methyl-1-[3-[(2-methylimidazol-1-yl)methyl]benzothiophen-2-yl]methanamine N-methyl-1-[3-[(2-methylimidazol…
| 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) | 2.37 | 8.98 | -96.79 | 3 | 3 | 2 | 36 | 273.405 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.37 | 7.06 | -7.43 | 1 | 3 | 0 | 30 | 271.389 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.37 | 8.51 | -48.43 | 2 | 3 | 1 | 34 | 272.397 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
