General Information of the Compound
| Compound ID |
CP0567633
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| Compound Name |
US9278960, 6-12
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| Structure |
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| Formula |
C23H18FN3O2
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| Molecular Weight |
387.414
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| Canonical SMILES |
COc1cncc(Cc2ccc3c(cc(nc3c2)C(N)=O)-c2ccc(F)cc2)c1
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| InChI |
InChI=1S/C23H18FN3O2/c1-29-18-9-15(12-26-13-18)8-14-2-7-19-20(16-3-5-17(24)6-4-16)11-22(23(25)28)27-21(19)10-14/h2-7,9-13H,8H2,1H3,(H2,25,28)
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| InChIKey |
YDSSBNQHIHUKCS-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