| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 24 | No |
Popular Name: 4-[(4-amino-1,2,5-oxadiazol-3-yl)azo]-2-[(Z)-p-tolyliminomethyl]phenol 4-[(4-amino-1,2,5-oxadiazol-3-yl…
| 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) | 4.22 | 3.29 | -15.2 | 3 | 8 | 0 | 122 | 322.328 | 4 | ↓ |
| Ref Reference (pH 7) | 4.22 | 2.22 | -12.62 | 3 | 8 | 0 | 122 | 322.328 | 4 | ↓ |
| Ref Reference (pH 7) | 4.22 | 3.32 | -11.23 | 3 | 8 | 0 | 122 | 322.328 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 4.11 | -43.79 | 2 | 8 | -1 | 125 | 321.32 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 3 | -40.33 | 2 | 8 | -1 | 125 | 321.32 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 4.07 | -33.32 | 2 | 8 | -1 | 125 | 321.32 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.22 | 2.66 | -38.84 | 4 | 8 | 1 | 124 | 323.336 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.22 | 3.72 | -32.91 | 4 | 8 | 1 | 124 | 323.336 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.22 | 3.72 | -48.62 | 4 | 8 | 1 | 124 | 323.336 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
