General Information of the Compound
| Compound ID |
CP0967412
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| Compound Name |
N-{[4'-(Dimethylamino)biphenyl-3-yl]methyl}-N-methylglycinamide ethanedioate
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| Structure |
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| Formula |
C20H25N3O5
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| Molecular Weight |
387.436
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| Canonical SMILES |
CN(Cc1cccc(-c2ccc(N(C)C)cc2)c1)C(=O)CN.O=C(O)C(=O)O
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| InChI |
InChI=1S/C18H23N3O.C2H2O4/c1-20(2)17-9-7-15(8-10-17)16-6-4-5-14(11-16)13-21(3)18(22)12-19;3-1(4)2(5)6/h4-11H,12-13,19H2,1-3H3;(H,3,4)(H,5,6)
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| InChIKey |
KALZVNWLWDJYSQ-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