General Information of the Compound
| Compound ID |
CP0219424
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| Compound Name |
US9266869, 6
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| Structure |
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| Formula |
C24H21FN4O3S
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| Molecular Weight |
464.522
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| Canonical SMILES |
Cc1ccc(F)c(c1)C(=O)Nc1cccc(c1)C#Cc1cc(cnc1N)C(=O)N=S(C)(C)=O
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| InChI |
InChI=1S/C24H21FN4O3S/c1-15-7-10-21(25)20(11-15)24(31)28-19-6-4-5-16(12-19)8-9-17-13-18(14-27-22(17)26)23(30)29-33(2,3)32/h4-7,10-14H,1-3H3,(H2,26,27)(H,28,31)
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| InChIKey |
QCKVLRNZROXNAA-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