General Information of the Compound
| Compound ID |
CP0391875
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| Compound Name |
4'-{[3-(2-Methoxy-acetylamino)-pyridin-2-ylamino]-methyl}-biphenyl-2-carboxylic acid methyl ester
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| Structure |
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| Formula |
C23H23N3O4
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| Molecular Weight |
405.454
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| Canonical SMILES |
COCC(=O)Nc1cccnc1NCc1ccc(cc1)-c1ccccc1C(=O)OC
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| InChI |
InChI=1S/C23H23N3O4/c1-29-15-21(27)26-20-8-5-13-24-22(20)25-14-16-9-11-17(12-10-16)18-6-3-4-7-19(18)23(28)30-2/h3-13H,14-15H2,1-2H3,(H,24,25)(H,26,27)
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| InChIKey |
ZLYBATPQQQIGSX-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