| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 33 | No |
| 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) | 4.12 | 6.37 | -44.01 | 3 | 7 | 1 | 97 | 464.615 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5-[4-[2-(2H-indol-3-yl)ethylamino]-4-keto-butyl]-N-phenyl-2,5-dihydro-1,3,4-thiadiazole-2-carboxamide](http://zinc12.docking.org/img/rings/365850.gif)