General Information of the Compound
| Compound ID |
CP0513171
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| Compound Name |
3-[3-[4-(aminomethyl)phenyl]imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
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| Structure |
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| Formula |
C18H16N6
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| Molecular Weight |
316.368
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| Canonical SMILES |
NCc1ccc(cc1)-n1c(nc2cccnc12)-c1cccnc1N
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| InChI |
InChI=1S/C18H16N6/c19-11-12-5-7-13(8-6-12)24-17(14-3-1-9-21-16(14)20)23-15-4-2-10-22-18(15)24/h1-10H,11,19H2,(H2,20,21)
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| InChIKey |
RGDKQPDDLFBPMH-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