| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 13th, 2008 | 26 | Yes |
Popular Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-3-methylsulfanyl-benzoic 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) | 2.75 | 5.02 | -51.97 | 1 | 7 | -1 | 105 | 394.45 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.75 | 5.1 | -102.86 | 0 | 7 | -2 | 107 | 393.442 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
