General Information of the Compound
| Compound ID |
CP0449466
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| Compound Name |
3-[(Z)-N-[[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]amino]-C-methylcarbonimidoyl]chromen-2-one
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| Structure |
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| Formula |
C20H13F2N3O2S
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| Molecular Weight |
397.406
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| Canonical SMILES |
C\C(=N\Nc1nc(cs1)-c1ccc(F)cc1F)c1cc2ccccc2oc1=O
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| InChI |
InChI=1S/C20H13F2N3O2S/c1-11(15-8-12-4-2-3-5-18(12)27-19(15)26)24-25-20-23-17(10-28-20)14-7-6-13(21)9-16(14)22/h2-10H,1H3,(H,23,25)/b24-11-
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| InChIKey |
LUSADHRVUFYJHL-MYKKPKGFSA-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