General Information of the Compound
| Compound ID |
CP0406661
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-[2-amino-4-(2-methylpropyl)-5-oxo-4H-imidazol-3-yl]-6-anilino-1,3,5-triazin-2-yl]guanidine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H22N10O
|
||||||||||||||||||
| Molecular Weight |
382.432
|
||||||||||||||||||
| Canonical SMILES |
CC(C)CC1N(C(N)=NC1=O)c1nc(NC(N)=N)nc(Nc2ccccc2)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H22N10O/c1-9(2)8-11-12(28)22-14(20)27(11)17-25-15(21-10-6-4-3-5-7-10)24-16(26-17)23-13(18)19/h3-7,9,11H,8H2,1-2H3,(H2,20,22,28)(H5,18,19,21,23,24,25,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
NGAIXAHLIFBQTF-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