General Information of the Compound
| Compound ID |
CP0563352
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| Compound Name |
US8680275, 51
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| Structure |
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| Formula |
C24H20FN5OS
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| Molecular Weight |
445.523
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| Canonical SMILES |
Cc1nc(C(=O)N2CC3CN(C3C2)c2cnc3ccccc3n2)c(s1)-c1ccccc1F
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| InChI |
InChI=1S/C24H20FN5OS/c1-14-27-22(23(32-14)16-6-2-3-7-17(16)25)24(31)29-11-15-12-30(20(15)13-29)21-10-26-18-8-4-5-9-19(18)28-21/h2-10,15,20H,11-13H2,1H3
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| InChIKey |
GQWQSRXZJIQFPF-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