General Information of the Compound
| Compound ID |
CP0870487
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| Compound Name |
cis-5-(4-methoxyphenyl)-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one
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| Structure |
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| Formula |
C18H26N2O2
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| Molecular Weight |
302.418
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| Canonical SMILES |
COc1ccc([C@@H]2C[C@H](CN3CCCCC3)C(=O)N2C)cc1
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| InChI |
InChI=1S/C18H26N2O2/c1-19-17(14-6-8-16(22-2)9-7-14)12-15(18(19)21)13-20-10-4-3-5-11-20/h6-9,15,17H,3-5,10-13H2,1-2H3/t15-,17+/m1/s1
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| InChIKey |
IMSIRAFLQWGKLO-WBVHZDCISA-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