General Information of the Compound
| Compound ID |
CP0402844
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| Compound Name |
2-(2-chloro-6-fluorophenyl)-4,4-dimethyl-7-(2-pyrimidin-5-ylethynyl)-3H-chromeno[3,4-d]imidazole
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| Structure |
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| Formula |
C24H16ClFN4O
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| Molecular Weight |
430.87
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| Canonical SMILES |
CC1(C)Oc2cc(ccc2-c2nc([nH]c12)-c1c(F)cccc1Cl)C#Cc1cncnc1
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| InChI |
InChI=1S/C24H16ClFN4O/c1-24(2)22-21(29-23(30-22)20-17(25)4-3-5-18(20)26)16-9-8-14(10-19(16)31-24)6-7-15-11-27-13-28-12-15/h3-5,8-13H,1-2H3,(H,29,30)
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| InChIKey |
UPLKLJZGYGKWOX-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