General Information of the Compound
| Compound ID |
CP0478138
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| Compound Name |
4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide
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| Structure |
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| Formula |
C15H24N4O2S
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| Molecular Weight |
324.45
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| Canonical SMILES |
CN(C)[C@H](CNC(=O)C1CCN(CC1)C(N)=O)c1cccs1
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| InChI |
InChI=1S/C15H24N4O2S/c1-18(2)12(13-4-3-9-22-13)10-17-14(20)11-5-7-19(8-6-11)15(16)21/h3-4,9,11-12H,5-8,10H2,1-2H3,(H2,16,21)(H,17,20)/t12-/m1/s1
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| InChIKey |
PFUWNWPSEZEGHK-GFCCVEGCSA-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