General Information of the Compound
| Compound ID |
CP0538757
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| Compound Name |
[1-(3-chloro-4-methylphenyl)pyrrolo[2,3-b]pyridin-2-yl]-(3-fluoroazetidin-1-yl)methanone
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| Structure |
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| Formula |
C18H15ClFN3O
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| Molecular Weight |
343.789
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| Canonical SMILES |
Cc1ccc(cc1Cl)-n1c(cc2cccnc12)C(=O)N1CC(F)C1
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| InChI |
InChI=1S/C18H15ClFN3O/c1-11-4-5-14(8-15(11)19)23-16(18(24)22-9-13(20)10-22)7-12-3-2-6-21-17(12)23/h2-8,13H,9-10H2,1H3
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| InChIKey |
WRNOEYNYBZRLBA-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