General Information of the Compound
| Compound ID |
CP0516193
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| Compound Name |
US9255103, 57
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| Structure |
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| Formula |
C21H20FN3O2
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| Molecular Weight |
365.408
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| Canonical SMILES |
Cc1c(COc2ccccc2)nn2CCN(Cc12)C(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C21H20FN3O2/c1-15-19(14-27-18-5-3-2-4-6-18)23-25-12-11-24(13-20(15)25)21(26)16-7-9-17(22)10-8-16/h2-10H,11-14H2,1H3
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| InChIKey |
HOFPALVKNDSITL-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