| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2011 | 19 | Yes |
Popular Name: 2-(4-prop-2-ynyl-1,4-diazepan-1-yl)-1H-benzimidazole 2-(4-prop-2-ynyl-1,4-diazepan-1-…
| 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) | 2.17 | 9.07 | -26.01 | 2 | 4 | 1 | 36 | 255.345 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 8.66 | -8.23 | 1 | 4 | 0 | 35 | 254.337 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
