General Information of the Compound
| Compound ID |
CP0282516
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| Compound Name |
3-(3-chloro-5-fluorophenyl)-2-(pyridin-4-yl)-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
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| Structure |
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| Formula |
C19H10ClFN4
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| Molecular Weight |
348.768
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| Canonical SMILES |
Fc1cc(Cl)cc(c1)-c1c([nH]c2ccc(nc12)C#N)-c1ccncc1
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| InChI |
InChI=1S/C19H10ClFN4/c20-13-7-12(8-14(21)9-13)17-18(11-3-5-23-6-4-11)25-16-2-1-15(10-22)24-19(16)17/h1-9,25H
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| InChIKey |
JQNWYOYBMABACN-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