General Information of the Compound
| Compound ID |
CP0575531
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-N-(4-chloro-2-methoxy-6-methylphenyl)-4-N-(6-methoxypyridin-3-yl)-3-methyl-4-N-propan-2-ylbenzimidazole-2,4-diamine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H28ClN5O2
|
||||||||||||||||||
| Molecular Weight |
465.985
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cn1)N(C(C)C)c1cccc2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H28ClN5O2/c1-15(2)31(18-10-11-22(33-6)27-14-18)20-9-7-8-19-24(20)30(4)25(28-19)29-23-16(3)12-17(26)13-21(23)32-5/h7-15H,1-6H3,(H,28,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KRMXBAQYUSWSEK-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