| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 20 | Yes |
Popular Name: 3-bromo-4-[[(4R)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]benzonitrile 3-bromo-4-[[(4R)-1-methyl-4,5,6,…
| 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) | 3.07 | 7.31 | -9.67 | 1 | 4 | 0 | 54 | 331.217 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 7.74 | -37.72 | 2 | 4 | 1 | 55 | 332.225 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
