| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2005 | 23 | Yes |
Popular Name: WHI-P154 WHI-P154
Find On: PubMed — Wikipedia — Google
CAS Numbers: 211555-04-3 , [211555-04-3]
| 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) | 3.79 | -2.11 | -12.26 | 2 | 6 | 0 | 76 | 376.21 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Target | JAK, EGFR | Selleck Chemicals |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80954-1-O | HFF (Foreskin Fibroblasts) (cluster #1 Of 4), Other | Other | 6343 | 0.32 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80954 | Z80954 | HFF (Foreskin Fibroblasts) | 6343 | 0.32 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.