| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 29 | No |
Popular Name: 1-cyano-3-[dibromo(oxo)BLAHyl]-2-(2,6-dimethylphenyl)isourea 1-cyano-3-[dibromo(oxo)BLAHyl]-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) | 5.96 | 12.61 | -35.02 | 0 | 7 | -1 | 86 | 518.189 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 5.96 | 13.01 | -11.13 | 1 | 7 | 0 | 84 | 519.197 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
