General Information of the Compound
| Compound ID |
CP0550641
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| Compound Name |
US9278960, 4-68
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| Structure |
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| Formula |
C20H22FN5O
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| Molecular Weight |
367.428
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| Canonical SMILES |
Cn1cc(cn1)-c1cc(nc2cc(CN3CCC(F)CC3)ccc12)C(N)=O
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| InChI |
InChI=1S/C20H22FN5O/c1-25-12-14(10-23-25)17-9-19(20(22)27)24-18-8-13(2-3-16(17)18)11-26-6-4-15(21)5-7-26/h2-3,8-10,12,15H,4-7,11H2,1H3,(H2,22,27)
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| InChIKey |
ZANUFYRNBVMFCV-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