General Information of the Compound
| Compound ID |
CP0484790
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| Compound Name |
1-ethyl-3-[5-ethyl-6-methyl-4-[(3-methylphenyl)methyl]-2-oxo-1H-pyridin-3-yl]thiourea
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| Structure |
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| Formula |
C19H25N3OS
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| Molecular Weight |
343.496
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| Canonical SMILES |
CCNC(=S)Nc1c(Cc2cccc(C)c2)c(CC)c(C)[nH]c1=O
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| InChI |
InChI=1S/C19H25N3OS/c1-5-15-13(4)21-18(23)17(22-19(24)20-6-2)16(15)11-14-9-7-8-12(3)10-14/h7-10H,5-6,11H2,1-4H3,(H,21,23)(H2,20,22,24)
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| InChIKey |
GUBDMTBMJBTZHX-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