| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2011 | 20 | No |
Popular Name: 3-[[2-cyclohexylethyl(methyl)amino]methyl]-5-(dimethylamino)-1,3,4-thiadiazole-2-thione 3-[[2-cyclohexylethyl(methyl)ami…
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| 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) | 3.37 | 8.43 | -8.35 | 0 | 4 | 0 | 24 | 314.524 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.37 | 10.89 | -36.66 | 1 | 4 | 1 | 26 | 315.532 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[(2-cyclohexylethylamino)methyl]-1,3,4-thiadiazole-2-thione](http://zinc12.docking.org/img/rings/298482.gif)