General Information of the Compound
| Compound ID |
CP0561449
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
8-[[5-[[3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-4-oxophthalazin-1-yl]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dichlorophenyl)octanamide
Show/Hide
|
||||||||||||||||||
| Formula |
C35H48Cl2N6O3SSi
|
||||||||||||||||||
| Molecular Weight |
731.867
|
||||||||||||||||||
| Canonical SMILES |
Cn1c(Cc2nn(CCCO[Si](C)(C)C(C)(C)C)c(=O)c3ccccc23)nnc1SCCCCCCCC(=O)Nc1ccc(Cl)cc1Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C35H48Cl2N6O3SSi/c1-35(2,3)48(5,6)46-21-14-20-43-33(45)27-16-12-11-15-26(27)30(41-43)24-31-39-40-34(42(31)4)47-22-13-9-7-8-10-17-32(44)38-29-19-18-25(36)23-28(29)37/h11-12,15-16,18-19,23H,7-10,13-14,17,20-22,24H2,1-6H3,(H,38,44)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UWFBQOBRCWVTNY-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT07276, Interleukin-15
Protein ID: PT03663, Interleukin-15
Protein ID: PT03664, Interleukin-2