General Information of the Compound
| Compound ID |
CP0557718
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| Compound Name |
2-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]methyl]phenyl]acetamide
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| Structure |
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| Formula |
C23H21ClN2O
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| Molecular Weight |
376.887
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| Canonical SMILES |
NC(=O)Cc1ccc(Cc2cc(nc3CCCc23)-c2cccc(Cl)c2)cc1
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| InChI |
InChI=1S/C23H21ClN2O/c24-19-4-1-3-17(13-19)22-14-18(20-5-2-6-21(20)26-22)11-15-7-9-16(10-8-15)12-23(25)27/h1,3-4,7-10,13-14H,2,5-6,11-12H2,(H2,25,27)
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| InChIKey |
DUFGBWRDRGDHHE-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