General Information of the Compound
Compound ID |
CP0724878
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
3-(3-methoxyphenyl)-7-(morpholine-4-carbonyl)-9H-carbazole-1-carboxamide
Show/Hide
|
||||||||||||||||||
Structure |
|
||||||||||||||||||
Formula |
C25H23N3O4
|
||||||||||||||||||
Molecular Weight |
429.476
|
||||||||||||||||||
Canonical SMILES |
COc1cccc(-c2cc(C(N)=O)c3[nH]c4cc(C(=O)N5CCOCC5)ccc4c3c2)c1
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C25H23N3O4/c1-31-18-4-2-3-15(11-18)17-12-20-19-6-5-16(25(30)28-7-9-32-10-8-28)14-22(19)27-23(20)21(13-17)24(26)29/h2-6,11-14,27H,7-10H2,1H3,(H2,26,29)
Show/Hide
|
||||||||||||||||||
InChIKey |
ADZCTJDBATVUAU-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
Protein ID: PT01214, Tyrosine-protein kinase JAK2
Cell Viability or Cytotoxicity Assay
Cell Line ID | Cell Line Name | Cell Line Organism | |
CL000068 | A-549 | Homo sapiens (Human) | 1 |
1 |
IC50 = 3080 nM
|
TI
LI
LO
TS
|
---|