General Information of the Compound
| Compound ID |
CP0374774
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| Compound Name |
5-[3-(2-propan-2-ylphenyl)pyridin-4-yl]-N-propyl-1,3-thiazol-2-amine
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| Structure |
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| Formula |
C20H23N3S
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| Molecular Weight |
337.492
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| Canonical SMILES |
CCCNc1ncc(s1)-c1ccncc1-c1ccccc1C(C)C
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| InChI |
InChI=1S/C20H23N3S/c1-4-10-22-20-23-13-19(24-20)17-9-11-21-12-18(17)16-8-6-5-7-15(16)14(2)3/h5-9,11-14H,4,10H2,1-3H3,(H,22,23)
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| InChIKey |
ILRKBLQVNQUEQM-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