General Information of the Compound
| Compound ID |
CP0458558
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| Compound Name |
2-(3-chloro-5-fluoropyridin-4-yl)-7-[2-[2-chloro-4-(trifluoromethyl)phenyl]ethynyl]-4,4-dimethyl-3H-chromeno[3,4-d]imidazole
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| Structure |
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| Formula |
C26H15Cl2F4N3O
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| Molecular Weight |
532.324
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| Canonical SMILES |
CC1(C)Oc2cc(ccc2-c2nc([nH]c12)-c1c(F)cncc1Cl)C#Cc1ccc(cc1Cl)C(F)(F)F
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| InChI |
InChI=1S/C26H15Cl2F4N3O/c1-25(2)23-22(34-24(35-23)21-18(28)11-33-12-19(21)29)16-8-4-13(9-20(16)36-25)3-5-14-6-7-15(10-17(14)27)26(30,31)32/h4,6-12H,1-2H3,(H,34,35)
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| InChIKey |
GJYUIIHOONUFPQ-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