General Information of the Compound
| Compound ID |
CP0659029
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| Compound Name |
(S)-cyclopentyl 6-methyl-2-oxo-4-(4-(trifluoromethyl)phenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
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| Structure |
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| Formula |
C18H19F3N2O3
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| Molecular Weight |
368.355
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| Canonical SMILES |
CC1=C(C(=O)OC2CCCC2)[C@H](c2ccc(C(F)(F)F)cc2)NC(=O)N1
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| InChI |
InChI=1S/C18H19F3N2O3/c1-10-14(16(24)26-13-4-2-3-5-13)15(23-17(25)22-10)11-6-8-12(9-7-11)18(19,20)21/h6-9,13,15H,2-5H2,1H3,(H2,22,23,25)/t15-/m0/s1
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| InChIKey |
ZDXBWMUUIAZABH-HNNXBMFYSA-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