General Information of the Compound
| Compound ID |
CP0459507
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| Compound Name |
5-(thiophen-2-ylsulfonyl)-5H-dibenzo[b,d]azepin-7(6H)-one
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| Structure |
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| Formula |
C18H13NO3S2
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| Molecular Weight |
355.44
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| Canonical SMILES |
O=C1CN(c2ccccc2-c2ccccc12)S(=O)(=O)c1cccs1
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| InChI |
InChI=1S/C18H13NO3S2/c20-17-12-19(24(21,22)18-10-5-11-23-18)16-9-4-3-7-14(16)13-6-1-2-8-15(13)17/h1-11H,12H2
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| InChIKey |
YORIAFCWXUMHOS-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