| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2008 | 31 | Yes |
Popular Name: N-(2-diethylaminoethyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide N-(2-diethylaminoethyl)-4-(3,4-d…
| 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) | 2.46 | 6.39 | -49.97 | 3 | 8 | 1 | 98 | 448.565 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.46 | 4.23 | -43.53 | 1 | 8 | -1 | 99 | 446.549 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 6.46 | -63.91 | 2 | 8 | 0 | 100 | 447.557 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
