General Information of the Compound
| Compound ID |
CP0132922
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| Compound Name |
4-ethyl-6-(5-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-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 |
CCc1cc(nc(N)n1)-c1c[nH]c2ncc(cc12)-c1cccnc1
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| InChI |
InChI=1S/C18H16N6/c1-2-13-7-16(24-18(19)23-13)15-10-22-17-14(15)6-12(9-21-17)11-4-3-5-20-8-11/h3-10H,2H2,1H3,(H,21,22)(H2,19,23,24)
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| InChIKey |
QDMKNNFWIFASRH-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