General Information of the Compound
| Compound ID |
CP0554188
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| Compound Name |
US8889668, I77
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| Structure |
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| Formula |
C23H19FN2O3
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| Molecular Weight |
390.414
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| Canonical SMILES |
COc1ccc(F)cc1-c1noc(n1)-c1ccc(c(CO)c1)-c1ccccc1C
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| InChI |
InChI=1S/C23H19FN2O3/c1-14-5-3-4-6-18(14)19-9-7-15(11-16(19)13-27)23-25-22(26-29-23)20-12-17(24)8-10-21(20)28-2/h3-12,27H,13H2,1-2H3
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| InChIKey |
SNEAVSPVVYSEHF-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