General Information of the Compound
| Compound ID |
CP0398739
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| Compound Name |
5-(4-chlorophenylsulfonyl)-5H-dibenzo[b,d]azepin-7(6H)-one
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| Structure |
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| Formula |
C20H14ClNO3S
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| Molecular Weight |
383.856
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| Canonical SMILES |
Clc1ccc(cc1)S(=O)(=O)N1CC(=O)c2ccccc2-c2ccccc12
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| InChI |
InChI=1S/C20H14ClNO3S/c21-14-9-11-15(12-10-14)26(24,25)22-13-20(23)18-7-2-1-5-16(18)17-6-3-4-8-19(17)22/h1-12H,13H2
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| InChIKey |
NCQAFCHSYFCQQI-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