| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2013 | 13 | Yes |
Popular Name: Hesperadin Hesperadin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 422513-13-1 , [422513-13-1]
| 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) | 4.97 | 10.8 | -65.41 | 3 | 7 | 0 | 98 | 516.667 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.00 | 7.05 | -3.21 | 0 | 1 | 0 | 9 | 196.677 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Target | Aurora Kinase | Selleck Chemicals |
No pre-computed analogs available. Try a structural similarity search.