General Information of the Compound
| Compound ID |
CP0183696
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| Compound Name |
3-(3-chlorophenyl)-7-(4-methylpiperazin-1-yl)-9H-carbazole-1-carboxamide
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| Structure |
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| Formula |
C24H23ClN4O
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| Molecular Weight |
418.928
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| Canonical SMILES |
CN1CCN(CC1)c1ccc2c(c1)[nH]c1c(cc(cc21)-c1cccc(Cl)c1)C(N)=O
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| InChI |
InChI=1S/C24H23ClN4O/c1-28-7-9-29(10-8-28)18-5-6-19-20-12-16(15-3-2-4-17(25)11-15)13-21(24(26)30)23(20)27-22(19)14-18/h2-6,11-14,27H,7-10H2,1H3,(H2,26,30)
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| InChIKey |
SIAGQGTWMHKSDK-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 = 2730 nM
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