General Information of the Compound
| Compound ID |
CP0847229
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| Compound Name |
N-(3-chloro-5-cyanophenyl)-1-(2,6-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
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| Structure |
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| Formula |
C20H18ClN3O2
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| Molecular Weight |
367.836
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| Canonical SMILES |
Cc1cccc(C)c1N1CC(C(=O)Nc2cc(Cl)cc(C#N)c2)CC1=O
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| InChI |
InChI=1S/C20H18ClN3O2/c1-12-4-3-5-13(2)19(12)24-11-15(8-18(24)25)20(26)23-17-7-14(10-22)6-16(21)9-17/h3-7,9,15H,8,11H2,1-2H3,(H,23,26)
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| InChIKey |
QEOROPIBUXOAHI-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