General Information of the Compound
| Compound ID |
CP0387752
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| Compound Name |
5-(4-(3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl)piperidin-1-yl)-1-isopropyl-1H-pyrrolo[2,3-b]pyridine
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| Structure |
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| Formula |
C23H23ClFN5O
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| Molecular Weight |
439.922
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| Canonical SMILES |
CC(C)n1ccc2cc(cnc12)N1CCC(CC1)c1nc(no1)-c1ccc(F)cc1Cl
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| InChI |
InChI=1S/C23H23ClFN5O/c1-14(2)30-10-7-16-11-18(13-26-22(16)30)29-8-5-15(6-9-29)23-27-21(28-31-23)19-4-3-17(25)12-20(19)24/h3-4,7,10-15H,5-6,8-9H2,1-2H3
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| InChIKey |
JFQSYCUGCCXESU-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