| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 21 | Yes |
Popular Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-propyl-imidazole-1,5-diamine 4-(3,4-dihydro-2H-1,5-benzodioxe…
| 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) | 1.60 | 5.98 | -31.23 | 5 | 6 | 1 | 90 | 289.359 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.60 | 5.59 | -11.65 | 4 | 6 | 0 | 88 | 288.351 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
