General Information of the Compound
| Compound ID |
CP0314463
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| Compound Name |
3-(1-(4-(methylamino)-1,3,5-triazin-2-yl)-1H-benzo[d]imidazol-2-ylamino)phenol
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| Structure |
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| Formula |
C17H15N7O
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| Molecular Weight |
333.355
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| Canonical SMILES |
CNc1ncnc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
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| InChI |
InChI=1S/C17H15N7O/c1-18-15-19-10-20-16(23-15)24-14-8-3-2-7-13(14)22-17(24)21-11-5-4-6-12(25)9-11/h2-10,25H,1H3,(H,21,22)(H,18,19,20,23)
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| InChIKey |
UNHLMXLXZKTYPJ-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