| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 30 | Yes |
Popular Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(2,5-dimethylphenyl)sulfonylamino]benzamide N-(5-butyl-1,3,4-thiadiazol-2-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) | 4.48 | 8.72 | -22.23 | 2 | 7 | 0 | 101 | 444.582 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 8.79 | -47.72 | 1 | 7 | -1 | 103 | 443.574 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.55 | 7.88 | -99.92 | 0 | 7 | -2 | 109 | 442.566 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.55 | 7.81 | -52.01 | 1 | 7 | -1 | 107 | 443.574 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
