| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 27 | No |
Popular Name: 2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]-N-tert-butyl-acetamide 2-[4-(2,1,3-benzothiadiazol-4-yl…
| 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) | 2.25 | 3.74 | -42.41 | 2 | 8 | 1 | 97 | 412.561 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 1.4 | -15.93 | 1 | 8 | 0 | 96 | 411.553 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
