General Information of the Compound
| Compound ID |
CP0077037
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| Compound Name |
N-[[3-[[3-[(5-chlorothiophen-2-yl)sulfonylamino]-4-methoxyindazol-1-yl]methyl]phenyl]methyl]oxane-4-carboxamide
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| Structure |
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| Formula |
C26H27ClN4O5S2
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| Molecular Weight |
575.112
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| Canonical SMILES |
COc1cccc2n(Cc3cccc(CNC(=O)C4CCOCC4)c3)nc(NS(=O)(=O)c3ccc(Cl)s3)c12
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| InChI |
InChI=1S/C26H27ClN4O5S2/c1-35-21-7-3-6-20-24(21)25(30-38(33,34)23-9-8-22(27)37-23)29-31(20)16-18-5-2-4-17(14-18)15-28-26(32)19-10-12-36-13-11-19/h2-9,14,19H,10-13,15-16H2,1H3,(H,28,32)(H,29,30)
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| InChIKey |
SPGINZOZRRSDPN-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