| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 21 | Yes |
Popular Name: N-[[3-(imidazol-1-ylmethyl)benzothiophen-2-yl]methyl]-2-methyl-propan-1-amine N-[[3-(imidazol-1-ylmethyl)benzo…
| 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) | 3.40 | 11.66 | -104.59 | 3 | 3 | 2 | 36 | 301.459 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 9.92 | -7.56 | 1 | 3 | 0 | 30 | 299.443 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 11.14 | -52.45 | 2 | 3 | 1 | 34 | 300.451 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
