General Information of the Compound
| Compound ID |
CP0477471
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| Compound Name |
4-[2-[6-(3-chlorophenyl)-4-methylpyridin-3-yl]pyrrolidine-1-carbonyl]-1-methylpyrrolidin-2-one
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| Structure |
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| Formula |
C22H24ClN3O2
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| Molecular Weight |
397.906
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| Canonical SMILES |
CN1CC(CC1=O)C(=O)N1CCCC1c1cnc(cc1C)-c1cccc(Cl)c1
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| InChI |
InChI=1S/C22H24ClN3O2/c1-14-9-19(15-5-3-6-17(23)10-15)24-12-18(14)20-7-4-8-26(20)22(28)16-11-21(27)25(2)13-16/h3,5-6,9-10,12,16,20H,4,7-8,11,13H2,1-2H3
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| InChIKey |
XPCPEMOBOVRMDQ-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