General Information of the Compound
| Compound ID |
CP0132767
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| Compound Name |
US9340555, 32
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| Structure |
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| Formula |
C24H21F2N5O3S
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| Molecular Weight |
497.527
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| Canonical SMILES |
Cc1ccc(F)c(NC(=O)Nc2ccc(Oc3ccnc4cc(sc34)C(=O)NCCN)cc2F)c1
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| InChI |
InChI=1S/C24H21F2N5O3S/c1-13-2-4-15(25)18(10-13)31-24(33)30-17-5-3-14(11-16(17)26)34-20-6-8-28-19-12-21(35-22(19)20)23(32)29-9-7-27/h2-6,8,10-12H,7,9,27H2,1H3,(H,29,32)(H2,30,31,33)
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| InChIKey |
SJAAIJHENJPXTP-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