General Information of the Compound
| Compound ID |
CP0549241
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| Compound Name |
N-[4-[[6-(1,3-thiazol-5-yl)quinazolin-4-yl]amino]phenyl]methanesulfonamide
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| Structure |
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| Formula |
C18H15N5O2S2
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| Molecular Weight |
397.485
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| Canonical SMILES |
CS(=O)(=O)Nc1ccc(Nc2ncnc3ccc(cc23)-c2cncs2)cc1
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| InChI |
InChI=1S/C18H15N5O2S2/c1-27(24,25)23-14-5-3-13(4-6-14)22-18-15-8-12(17-9-19-11-26-17)2-7-16(15)20-10-21-18/h2-11,23H,1H3,(H,20,21,22)
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| InChIKey |
KYBPXBQXLVGFOP-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