General Information of the Compound
| Compound ID |
CP0441010
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| Compound Name |
5-[2-(2,6-Dichloro-3-methyl-phenylamino)-phenyl]-[1,3,4]thiadiazol-2-yl-cyanamide
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| Structure |
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| Formula |
C16H11Cl2N5S
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| Molecular Weight |
376.272
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| Canonical SMILES |
Cc1ccc(Cl)c(Nc2ccccc2-c2nnc(NC#N)s2)c1Cl
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| InChI |
InChI=1S/C16H11Cl2N5S/c1-9-6-7-11(17)14(13(9)18)21-12-5-3-2-4-10(12)15-22-23-16(24-15)20-8-19/h2-7,21H,1H3,(H,20,23)
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| InChIKey |
ZHDOHGQPEWPZLR-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