General Information of the Compound
| Compound ID |
CP0345799
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| Compound Name |
2-(2-aminopyridin-4-yl)-3-(3-chloro-4-fluorophenyl)-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
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| Structure |
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| Formula |
C19H11ClFN5
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| Molecular Weight |
363.783
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| Canonical SMILES |
Nc1cc(ccn1)-c1[nH]c2ccc(nc2c1-c1ccc(F)c(Cl)c1)C#N
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| InChI |
InChI=1S/C19H11ClFN5/c20-13-7-10(1-3-14(13)21)17-18(11-5-6-24-16(23)8-11)26-15-4-2-12(9-22)25-19(15)17/h1-8,26H,(H2,23,24)
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| InChIKey |
PQCPYSVTVBSQJY-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