| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2010 | 29 | No |
Popular Name: (Z)-2-(1,2-benzoxazol-3-yl)-3-[2-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]prop-2-enenitrile (Z)-2-(1,2-benzoxazol-3-yl)-3-[2…
| 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) | 3.57 | 9.86 | -40.57 | 1 | 6 | 1 | 67 | 389.479 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 9.74 | -44.73 | 1 | 6 | 1 | 67 | 389.479 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 7.49 | -9.68 | 0 | 6 | 0 | 66 | 388.471 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[2-[2-(2-piperazinoethoxy)phenyl]vinyl]indoxazene](http://zinc12.docking.org/img/rings/513461.gif)