General Information of the Compound
| Compound ID |
CP0527518
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-N-[2-[[2-(2-methylpropylamino)pyrimidin-4-yl]amino]ethyl]-6-phenylpyrimidine-2,4-diamine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H26N8
|
||||||||||||||||||
| Molecular Weight |
378.484
|
||||||||||||||||||
| Canonical SMILES |
CC(C)CNc1nccc(NCCNc2cc(nc(N)n2)-c2ccccc2)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H26N8/c1-14(2)13-25-20-24-9-8-17(28-20)22-10-11-23-18-12-16(26-19(21)27-18)15-6-4-3-5-7-15/h3-9,12,14H,10-11,13H2,1-2H3,(H3,21,23,26,27)(H2,22,24,25,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UTFWBUWETGGIEE-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 | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| 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