General Information of the Compound
| Compound ID |
CP0050336
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(4-methyl-6-(methylamino)-1,3,5-triazin-2-yl)-N-(1H-pyrazol-3-yl)-1H-benzo[d]imidazol-2-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H15N9
|
||||||||||||||||||
| Molecular Weight |
321.348
|
||||||||||||||||||
| Canonical SMILES |
CNc1nc(C)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H15N9/c1-9-18-13(16-2)22-14(19-9)24-11-6-4-3-5-10(11)20-15(24)21-12-7-8-17-23-12/h3-8H,1-2H3,(H,16,18,19,22)(H2,17,20,21,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
QVKFMCDAOONIMX-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