| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 22 | Yes |
Popular Name: 4-[(1,3,5-trimethylpyrazol-4-yl)methylamino]cinnoline-3-carbonitrile 4-[(1,3,5-trimethylpyrazol-4-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) | 1.93 | 5.14 | -12.85 | 1 | 6 | 0 | 79 | 292.346 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.93 | 5.28 | -39.4 | 2 | 6 | 1 | 81 | 293.354 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
