| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 22 | No |
Popular Name: 2-[[2,1,3-benzothiadiazol-5-ylmethyl(methyl)amino]methyl]benzoic 2-[[2,1,3-benzothiadiazol-5-ylme…
| 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) | 2.73 | 8.72 | -43.89 | 1 | 5 | 0 | 70 | 313.382 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.73 | 6.7 | -47.59 | 0 | 5 | -1 | 69 | 312.374 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
