General Information of the Compound
| Compound ID |
CP0390311
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| Compound Name |
4-(benzhydrylsulfanylmethyl)-2-methyl-1,3-thiazole
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| Structure |
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| Formula |
C18H17NS2
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| Molecular Weight |
311.475
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| Canonical SMILES |
Cc1nc(CSC(c2ccccc2)c2ccccc2)cs1
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| InChI |
InChI=1S/C18H17NS2/c1-14-19-17(12-20-14)13-21-18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-12,18H,13H2,1H3
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| InChIKey |
BDIPZVQNUSNKPM-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