| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 5th, 2011 | 25 | Yes |
Popular Name: 2-[isopropyl-[(5-methyl-2-thienyl)methyl]amino]-N-(4-sulfamoylphenyl)acetamide 2-[isopropyl-[(5-methyl-2-thieny…
| 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) | 2.40 | 4.24 | -51.53 | 4 | 6 | 1 | 94 | 382.531 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.40 | 2.48 | -18.5 | 3 | 6 | 0 | 93 | 381.523 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.22 | 3.82 | -35.94 | 3 | 6 | 0 | 100 | 381.523 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
