General Information of the Compound
| Compound ID |
CP0191661
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| Compound Name |
N-[[3-[[3-[(5-chlorothiophen-2-yl)sulfonylamino]-4-methoxyindazol-1-yl]methyl]phenyl]methyl]oxolane-2-carboxamide
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| Structure |
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| Formula |
C25H25ClN4O5S2
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| Molecular Weight |
561.085
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| Canonical SMILES |
COc1cccc2n(Cc3cccc(CNC(=O)C4CCCO4)c3)nc(NS(=O)(=O)c3ccc(Cl)s3)c12
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| InChI |
InChI=1S/C25H25ClN4O5S2/c1-34-19-8-3-7-18-23(19)24(29-37(32,33)22-11-10-21(26)36-22)28-30(18)15-17-6-2-5-16(13-17)14-27-25(31)20-9-4-12-35-20/h2-3,5-8,10-11,13,20H,4,9,12,14-15H2,1H3,(H,27,31)(H,28,29)
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| InChIKey |
WHBKLJUDRBLALA-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