General Information of the Compound
Compound ID |
CP0050333
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Compound Name |
3-(1-(4-amino-6-methyl-1,3,5-triazin-2-yl)-1H-benzo[d]imidazol-2-ylamino)benzamide
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Structure |
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Formula |
C18H16N8O
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Molecular Weight |
360.381
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Canonical SMILES |
Cc1nc(N)nc(n1)-n1c(Nc2cccc(c2)C(N)=O)nc2ccccc12
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InChI |
InChI=1S/C18H16N8O/c1-10-21-16(20)25-17(22-10)26-14-8-3-2-7-13(14)24-18(26)23-12-6-4-5-11(9-12)15(19)27/h2-9H,1H3,(H2,19,27)(H,23,24)(H2,20,21,22,25)
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InChIKey |
FZSPKQZLGNEFOS-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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