General Information of the Compound
| Compound ID |
CP0470139
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| Compound Name |
US9000044, 65
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| Structure |
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| Formula |
C26H20ClNO3
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| Molecular Weight |
429.903
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| Canonical SMILES |
Cc1c(CC(O)=O)cc2ccc(Cl)cc2c1-c1ccc(NC(=O)c2ccccc2)cc1
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| InChI |
InChI=1S/C26H20ClNO3/c1-16-20(14-24(29)30)13-19-7-10-21(27)15-23(19)25(16)17-8-11-22(12-9-17)28-26(31)18-5-3-2-4-6-18/h2-13,15H,14H2,1H3,(H,28,31)(H,29,30)
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| InChIKey |
ZSHQTYKDRHGEPB-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