General Information of the Compound
| Compound ID |
CP0906413
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| Compound Name |
N-Methyl-N-{[4'-(morpholin-4-yl)biphenyl-3-yl]methyl}glycinamide ethanedioate
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| Structure |
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| Formula |
C22H27N3O6
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| Molecular Weight |
429.473
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| Canonical SMILES |
CN(Cc1cccc(-c2ccc(N3CCOCC3)cc2)c1)C(=O)CN.O=C(O)C(=O)O
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| InChI |
InChI=1S/C20H25N3O2.C2H2O4/c1-22(20(24)14-21)15-16-3-2-4-18(13-16)17-5-7-19(8-6-17)23-9-11-25-12-10-23;3-1(4)2(5)6/h2-8,13H,9-12,14-15,21H2,1H3;(H,3,4)(H,5,6)
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| InChIKey |
HLMMABDWMUVQPA-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
Protein ID: PT03817, Membrane primary amine oxidase
Protein ID: PT02562, Membrane primary amine oxidase