| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2011 | 22 | No |
Popular Name: 2-(3-cyano-1,2,4-triazol-4-yl)-N-(2,6-dibromo-4-nitro-phenyl)acetamide 2-(3-cyano-1,2,4-triazol-4-yl)-N…
| 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) | 1.56 | 8.78 | -19.61 | 1 | 9 | 0 | 129 | 430.016 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 7.09 | -30.84 | 0 | 9 | -1 | 136 | 429.008 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
