General Information of the Compound
| Compound ID |
CP0883763
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| Compound Name |
N-cyclohexyl-5-methyl-4-oxo-3-(2-oxo-2-(3-(trifluoromethyl)phenylamino)ethyl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
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| Structure |
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| Formula |
C23H23F3N4O3S
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| Molecular Weight |
492.523
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| Canonical SMILES |
Cc1c(C(=O)NC2CCCCC2)sc2ncn(CC(=O)Nc3cccc(C(F)(F)F)c3)c(=O)c12
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| InChI |
InChI=1S/C23H23F3N4O3S/c1-13-18-21(34-19(13)20(32)29-15-7-3-2-4-8-15)27-12-30(22(18)33)11-17(31)28-16-9-5-6-14(10-16)23(24,25)26/h5-6,9-10,12,15H,2-4,7-8,11H2,1H3,(H,28,31)(H,29,32)
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| InChIKey |
RKFIMQHVDNNRGK-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