General Information of the Compound
| Compound ID |
CP0101935
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| Compound Name |
4-[5-(4-Ethyl-phenyl)-3-(4-fluoro-phenyl)-1H-pyrrol-2-yl]-pyridine
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| Structure |
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| Formula |
C23H19FN2
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| Molecular Weight |
342.417
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| Canonical SMILES |
CCc1ccc(cc1)-c1cc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C23H19FN2/c1-2-16-3-5-18(6-4-16)22-15-21(17-7-9-20(24)10-8-17)23(26-22)19-11-13-25-14-12-19/h3-15,26H,2H2,1H3
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| InChIKey |
SRVSGIFIEMIEKA-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