General Information of the Compound
| Compound ID |
CP0528733
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| Compound Name |
5-(4-Bromo-thiophen-2-yl)-6-(3,4-dimethoxy-phenyl)-7-thiophen-2-yl-pyrido[2,3-d]pyrimidin-4-ylamine
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| Structure |
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| Formula |
C23H17BrN4O2S2
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| Molecular Weight |
525.453
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| Canonical SMILES |
COc1ccc(cc1OC)-c1c(nc2ncnc(N)c2c1-c1cc(Br)cs1)-c1cccs1
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| InChI |
InChI=1S/C23H17BrN4O2S2/c1-29-14-6-5-12(8-15(14)30-2)18-19(17-9-13(24)10-32-17)20-22(25)26-11-27-23(20)28-21(18)16-4-3-7-31-16/h3-11H,1-2H3,(H2,25,26,27,28)
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| InChIKey |
BRTLQWCNNYBHST-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