General Information of the Compound
| Compound ID |
CP0438060
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| Compound Name |
2-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]sulfonyl]phenyl]acetamide
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| Structure |
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| Formula |
C22H19ClN2O3S
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| Molecular Weight |
426.925
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| Canonical SMILES |
NC(=O)Cc1ccc(cc1)S(=O)(=O)c1cc(nc2CCCc12)-c1cccc(Cl)c1
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| InChI |
InChI=1S/C22H19ClN2O3S/c23-16-4-1-3-15(12-16)20-13-21(18-5-2-6-19(18)25-20)29(27,28)17-9-7-14(8-10-17)11-22(24)26/h1,3-4,7-10,12-13H,2,5-6,11H2,(H2,24,26)
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| InChIKey |
ADVRVWAAZIHFNK-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