| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | No |
Popular Name: 3-[[(4-bromo-2-thienyl)methyl-methyl-amino]methyl]-5-isopropoxy-1,3,4-thiadiazole-2-thione 3-[[(4-bromo-2-thienyl)methyl-me…
| 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) | 3.36 | 5.68 | -6.9 | 0 | 4 | 0 | 30 | 394.385 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.36 | 6.17 | -33.17 | 1 | 4 | 1 | 32 | 395.393 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[(2-thenylamino)methyl]-1,3,4-thiadiazole-2-thione](http://zinc12.docking.org/img/rings/124440.gif)