General Information of the Compound
| Compound ID |
CP0486522
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| Compound Name |
US10047103, 71
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| Structure |
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| Formula |
C24H18FN5O4S2
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| Molecular Weight |
523.571
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| Canonical SMILES |
COc1nn2cc(nc2s1)-c1cc2c(OCc3nc(sc3C)-c3ccnc(F)c3)cc(OC)cc2o1
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| InChI |
InChI=1S/C24H18FN5O4S2/c1-12-17(27-22(35-12)13-4-5-26-21(25)6-13)11-33-18-7-14(31-2)8-19-15(18)9-20(34-19)16-10-30-23(28-16)36-24(29-30)32-3/h4-10H,11H2,1-3H3
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| InChIKey |
JWJMVMWCNXTJRS-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