| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2011 | 19 | No |
Popular Name: N-[(4-isopropyl-5-sulfanyl-1,2,4-triazol-3-yl)methyl]-3-methyl-furan-2-carboxamide N-[(4-isopropyl-5-sulfanyl-1,2,4…
| 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) | 0.52 | 5.38 | -12.84 | 2 | 6 | 0 | 76 | 280.353 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 5.19 | -43.58 | 1 | 6 | -1 | 73 | 279.345 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[(5-thioxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]-2-furamide](http://zinc12.docking.org/img/rings/305427.gif)