General Information of the Compound
| Compound ID |
CP0865169
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| Compound Name |
cis-5-(2-(2-chlorophenyl)thiazol-5-yl)-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one
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| Structure |
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| Formula |
C20H24ClN3OS
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| Molecular Weight |
389.952
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| Canonical SMILES |
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1cnc(-c2ccccc2Cl)s1
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| InChI |
InChI=1S/C20H24ClN3OS/c1-23-17(11-14(20(23)25)13-24-9-5-2-6-10-24)18-12-22-19(26-18)15-7-3-4-8-16(15)21/h3-4,7-8,12,14,17H,2,5-6,9-11,13H2,1H3/t14-,17+/m1/s1
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| InChIKey |
BYRXTRIVTYAFPL-PBHICJAKSA-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