General Information of the Compound
| Compound ID |
CP0445923
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| Compound Name |
4-tert-butyl-N-(1-methylindol-4-yl)-1,3-thiazol-2-amine
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| Structure |
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| Formula |
C16H19N3S
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| Molecular Weight |
285.416
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| Canonical SMILES |
Cn1ccc2c(Nc3nc(cs3)C(C)(C)C)cccc12
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| InChI |
InChI=1S/C16H19N3S/c1-16(2,3)14-10-20-15(18-14)17-12-6-5-7-13-11(12)8-9-19(13)4/h5-10H,1-4H3,(H,17,18)
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| InChIKey |
RMQJMOPZMRYIKK-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