| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 28th, 2011 | 17 | No |
Popular Name: 3-bromo-N-[(4-methyl-5-sulfanyl-1,2,4-triazol-3-yl)methyl]thiophene-2-carboxamide 3-bromo-N-[(4-methyl-5-sulfanyl-…
| 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) | 0.78 | 5.17 | -15.21 | 2 | 5 | 0 | 63 | 333.236 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.51 | 4.93 | -43.4 | 1 | 5 | -1 | 60 | 332.228 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[(5-thioxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]thiophene-2-carboxamide](http://zinc12.docking.org/img/rings/305494.gif)