General Information of the Compound
| Compound ID |
CP0457603
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| Compound Name |
2-(2-chloro-6-fluorophenyl)-4,4-dimethyl-7-[2-[2-(trifluoromethyl)phenyl]ethynyl]-3H-chromeno[3,4-d]imidazole
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| Structure |
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| Formula |
C27H17ClF4N2O
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| Molecular Weight |
496.891
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| Canonical SMILES |
CC1(C)Oc2cc(ccc2-c2[nH]c(nc12)-c1c(F)cccc1Cl)C#Cc1ccccc1C(F)(F)F
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| InChI |
InChI=1S/C27H17ClF4N2O/c1-26(2)24-23(33-25(34-24)22-19(28)8-5-9-20(22)29)17-13-11-15(14-21(17)35-26)10-12-16-6-3-4-7-18(16)27(30,31)32/h3-9,11,13-14H,1-2H3,(H,33,34)
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| InChIKey |
YLAZWMIHDJYMDS-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