General Information of the Compound
| Compound ID |
CP0580033
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| Compound Name |
benzo[b][1]benzothiepin-5-yl dihydrogen phosphate
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| Structure |
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| Formula |
C14H11O4PS
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| Molecular Weight |
306.279
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| Canonical SMILES |
OP(O)(=O)OC1=Cc2ccccc2Sc2ccccc12
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| InChI |
InChI=1S/C14H11O4PS/c15-19(16,17)18-12-9-10-5-1-3-7-13(10)20-14-8-4-2-6-11(12)14/h1-9H,(H2,15,16,17)
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| InChIKey |
WYJKIARCSUOJGR-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