General Information of the Compound
| Compound ID |
CP0568503
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-acetamido-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)pyridin-2-yl]-1H-indole-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H21N7O2
|
||||||||||||||||||
| Molecular Weight |
403.446
|
||||||||||||||||||
| Canonical SMILES |
CC(C)n1cnnc1-c1cccc(NC(=O)c2cc3cccc(NC(C)=O)c3[nH]2)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H21N7O2/c1-12(2)28-11-22-27-20(28)16-8-5-9-18(24-16)26-21(30)17-10-14-6-4-7-15(19(14)25-17)23-13(3)29/h4-12,25H,1-3H3,(H,23,29)(H,24,26,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
WKEUSOIWGYPPHH-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