General Information of the Compound
| Compound ID |
CP0536349
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| Compound Name |
4-(2-ethyl-4-methyl-1,3-thiazol-5-yl)-N-(2-ethylphenyl)-1,3-thiazol-2-amine
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| Structure |
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| Formula |
C17H19N3S2
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| Molecular Weight |
329.494
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| Canonical SMILES |
CCc1nc(C)c(s1)-c1csc(Nc2ccccc2CC)n1
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| InChI |
InChI=1S/C17H19N3S2/c1-4-12-8-6-7-9-13(12)19-17-20-14(10-21-17)16-11(3)18-15(5-2)22-16/h6-10H,4-5H2,1-3H3,(H,19,20)
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| InChIKey |
RVVBOCHPYMFNAM-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