General Information of the Compound
| Compound ID |
CP0291719
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| Compound Name |
4-(Benzothiazol-5-ylamino)-6-(benzyl-methyl-amino)-[1,3,5]triazin-2-ol
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| Structure |
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| Formula |
C18H16N6OS
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| Molecular Weight |
364.434
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| Canonical SMILES |
CN(Cc1ccccc1)c1nc(Nc2ccc3scnc3c2)[nH]c(=O)n1
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| InChI |
InChI=1S/C18H16N6OS/c1-24(10-12-5-3-2-4-6-12)17-21-16(22-18(25)23-17)20-13-7-8-15-14(9-13)19-11-26-15/h2-9,11H,10H2,1H3,(H2,20,21,22,23,25)
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| InChIKey |
VMRHPZPEPRKOPG-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