General Information of the Compound
| Compound ID |
CP0321647
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| Compound Name |
3-(3-methoxyphenyl)-7-(oxane-4-carbonylamino)-9H-carbazole-1-carboxamide
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| Structure |
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| Formula |
C26H25N3O4
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| Molecular Weight |
443.503
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| Canonical SMILES |
COc1cccc(c1)-c1cc(C(N)=O)c2[nH]c3cc(NC(=O)C4CCOCC4)ccc3c2c1
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| InChI |
InChI=1S/C26H25N3O4/c1-32-19-4-2-3-16(11-19)17-12-21-20-6-5-18(28-26(31)15-7-9-33-10-8-15)14-23(20)29-24(21)22(13-17)25(27)30/h2-6,11-15,29H,7-10H2,1H3,(H2,27,30)(H,28,31)
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| InChIKey |
PWEPWMLHOYLQNO-UHFFFAOYSA-N
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| 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
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Map of Molecular Bioactivity Related to the Compound
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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 |
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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 = 1310 nM
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