General Information of the Compound
| Compound ID |
CP0486870
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| Compound Name |
5-[(2-phenylethylamino)methyl]-N-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)-1,3-thiazol-2-amine
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| Structure |
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| Formula |
C19H15Cl3F3N3S
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| Molecular Weight |
480.77
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| Canonical SMILES |
FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CNCCc1ccccc1
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| InChI |
InChI=1S/C19H15Cl3F3N3S/c20-12-8-13(21)16(14(22)9-12)27-18-28-17(19(23,24)25)15(29-18)10-26-7-6-11-4-2-1-3-5-11/h1-5,8-9,26H,6-7,10H2,(H,27,28)
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| InChIKey |
FIVFVLGWZIHRKE-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