General Information of the Compound
Compound ID |
CP0411808
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Compound Name |
N-(7,7-dimethyl-9-oxo-6,8-dihydrodibenzofuran-3-yl)-2-oxo-1H-benzo[cd]indole-6-sulfonamide
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Structure |
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Formula |
C25H20N2O5S
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Molecular Weight |
460.511
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Canonical SMILES |
CC1(C)Cc2oc3cc(NS(=O)(=O)c4ccc5NC(=O)c6cccc4c56)ccc3c2C(=O)C1
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InChI |
InChI=1S/C25H20N2O5S/c1-25(2)11-18(28)23-14-7-6-13(10-19(14)32-20(23)12-25)27-33(30,31)21-9-8-17-22-15(21)4-3-5-16(22)24(29)26-17/h3-10,27H,11-12H2,1-2H3,(H,26,29)
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InChIKey |
IGHMIAGOLBUWJQ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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