| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 18 | No |
Popular Name: 4-[(1S)-3-(2-furyl)-1-methyl-propyl]-5-isopropyl-1,2,4-triazole-3-thiol 4-[(1S)-3-(2-furyl)-1-methyl-pro…
| 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) | 2.29 | 9.12 | -12.64 | 1 | 4 | 0 | 47 | 265.382 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.01 | 8.77 | -49.66 | 0 | 4 | -1 | 44 | 264.374 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4-[3-(2-furyl)propyl]-1H-1,2,4-triazole-5-thione](http://zinc12.docking.org/img/rings/589391.gif)