| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 23 | No |
Popular Name: (4Z)-4-[[(5-tert-butyl-1,3,4-thiadiazol-2-yl)amino]methylene]isoquinoline-1,3-dione (4Z)-4-[[(5-tert-butyl-1,3,4-thi…
| 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) | 2.72 | 6.03 | -10.01 | 2 | 6 | 0 | 88 | 328.397 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4-[(1,3,4-thiadiazol-2-ylamino)methylene]isoquinoline-1,3-quinone](http://zinc12.docking.org/img/rings/381906.gif)