| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 18 | No |
Popular Name: 4,5-dimethyl-3-[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thiophen-2-amine 4,5-dimethyl-3-[5-(2-thienyl)-1H…
| 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) | 2.60 | 5.55 | -11.55 | 2 | 4 | 0 | 65 | 276.39 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.60 | 5.32 | -46.88 | 1 | 4 | -1 | 64 | 275.382 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.20 | 6.33 | -8.24 | 3 | 4 | 0 | 68 | 276.39 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[4-[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]-2H-thiophen-5-ylidene]amine](http://zinc12.docking.org/img/rings/145064.gif)