General Information of the Compound
| Compound ID |
CP0577740
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| Compound Name |
Benvitimod
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| Synonyms |
GSK-2894512
GSK2894512
Tapinarof
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| Structure |
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| Formula |
C17H18O2
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| Molecular Weight |
254.329
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| Canonical SMILES |
CC(C)c1c(O)cc(\C=C\c2ccccc2)cc1O
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| InChI |
InChI=1S/C17H18O2/c1-12(2)17-15(18)10-14(11-16(17)19)9-8-13-6-4-3-5-7-13/h3-12,18-19H,1-2H3/b9-8+
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| InChIKey |
ZISJNXNHJRQYJO-CMDGGOBGSA-N
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| CAS |
79338-84-4
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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
Clinical Information about the Compound