| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 26th, 2008 | 25 | Yes |
Popular Name: 1-methyl-3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)carbamoyl]pyrazole-4-carboxylic 1-methyl-3-[(6-methylsulfonyl-1,…
| 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) | 0.42 | 4.47 | -73.23 | 1 | 9 | -1 | 134 | 379.399 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.49 | 2.33 | -136.03 | 0 | 9 | -2 | 140 | 378.391 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
