General Information of the Compound
| Compound ID |
CP0156157
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| Compound Name |
5-chloro-N-[4-methoxy-1-[[3-[(oxetan-3-ylamino)methyl]phenyl]methyl]indazol-3-yl]thiophene-2-sulfonamide
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| Structure |
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| Formula |
C23H23ClN4O4S2
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| Molecular Weight |
519.048
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| Canonical SMILES |
COc1cccc2n(Cc3cccc(CNC4COC4)c3)nc(NS(=O)(=O)c3ccc(Cl)s3)c12
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| InChI |
InChI=1S/C23H23ClN4O4S2/c1-31-19-7-3-6-18-22(19)23(27-34(29,30)21-9-8-20(24)33-21)26-28(18)12-16-5-2-4-15(10-16)11-25-17-13-32-14-17/h2-10,17,25H,11-14H2,1H3,(H,26,27)
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| InChIKey |
PJXQVBYWJSJHRY-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