General Information of the Compound
| Compound ID |
CP0217619
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| Compound Name |
N-[[3-[[3-[(5-chlorothiophen-2-yl)sulfonylamino]-4-(2-hydroxypropan-2-yl)indazol-1-yl]methyl]phenyl]methyl]acetamide
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| Structure |
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| Formula |
C24H25ClN4O4S2
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| Molecular Weight |
533.075
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| Canonical SMILES |
CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(cccc23)C(C)(C)O)c1
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| InChI |
InChI=1S/C24H25ClN4O4S2/c1-15(30)26-13-16-6-4-7-17(12-16)14-29-19-9-5-8-18(24(2,3)31)22(19)23(27-29)28-35(32,33)21-11-10-20(25)34-21/h4-12,31H,13-14H2,1-3H3,(H,26,30)(H,27,28)
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| InChIKey |
VKGBGXKPNDCEJE-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