General Information of the Compound
| Compound ID |
CP0482919
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| Compound Name |
2,2,2-trifluoroethyl 4-(furan-2-yl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
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| Structure |
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| Formula |
C18H14F3N3O3
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| Molecular Weight |
377.322
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| Canonical SMILES |
CC1=C(C(c2ccco2)n2c(N1)nc1ccccc21)C(=O)OCC(F)(F)F
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| InChI |
InChI=1S/C18H14F3N3O3/c1-10-14(16(25)27-9-18(19,20)21)15(13-7-4-8-26-13)24-12-6-3-2-5-11(12)23-17(24)22-10/h2-8,15H,9H2,1H3,(H,22,23)
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| InChIKey |
YLBXODHZSOMLIX-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