General Information of the Compound
| Compound ID |
CP0530612
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| Compound Name |
US9278960, 7-34
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| Structure |
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| Formula |
C22H20FN5O
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| Molecular Weight |
389.434
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| Canonical SMILES |
Cc1cc(Cc2ccc3c(cc(nc3c2F)C(N)=O)-c2cnn(C)c2)cc(C)n1
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| InChI |
InChI=1S/C22H20FN5O/c1-12-6-14(7-13(2)26-12)8-15-4-5-17-18(16-10-25-28(3)11-16)9-19(22(24)29)27-21(17)20(15)23/h4-7,9-11H,8H2,1-3H3,(H2,24,29)
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| InChIKey |
IRMUJRBEBCVTAA-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