| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 3rd, 2009 | 28 | Yes |
Popular Name: BI-D1870 BI-D1870
Find On: PubMed — Wikipedia — Google
CAS Numbers: 501437-28-1 , [501437-28-1]
2-((3,5-Difluoro-4-hydroxyphenyl)amino)-8-isopentyl-5,7-dimethyl-7,8-dihydropteridin-6(5H)-one
2-(3,5-Difluoro-4-hydroxyphenylamino)-8-isopentyl-5,7-dimethyl-7,8-dihydropteridin-6(5h)-one
2-[(3,5-Difluoro-4-hydroxyphenyl)amino]-5,7-dimethyl-8-(3-methylbutyl)-7,8-dihydropteridin-6(5H)-one
| 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) | 3.93 | 7.63 | -11.57 | 2 | 7 | 0 | 82 | 391.422 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.93 | 8.35 | -50.44 | 1 | 7 | -1 | 84 | 390.414 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.93 | 7.83 | -40.47 | 3 | 7 | 1 | 83 | 392.43 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Target | S6 Kinase | Selleck Chemicals |
No pre-computed analogs available. Try a structural similarity search.