General Information of the Compound
| Compound ID |
CP0492022
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| Compound Name |
5-[[bis(cyclopropylmethyl)amino]methyl]-N-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)-1,3-thiazol-2-amine
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| Structure |
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| Formula |
C19H19Cl3F3N3S
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| Molecular Weight |
484.802
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| Canonical SMILES |
FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN(CC1CC1)CC1CC1
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| InChI |
InChI=1S/C19H19Cl3F3N3S/c20-12-5-13(21)16(14(22)6-12)26-18-27-17(19(23,24)25)15(29-18)9-28(7-10-1-2-10)8-11-3-4-11/h5-6,10-11H,1-4,7-9H2,(H,26,27)
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| InChIKey |
NZZKWIYCGSZOML-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