General Information of the Compound
| Compound ID |
CP0143997
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| Compound Name |
2-methoxy-5-[4-methyl-5-(4-piperazin-1-ylphenyl)pyridin-3-yl]benzamide
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| Structure |
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| Formula |
C24H26N4O2
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| Molecular Weight |
402.498
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| Canonical SMILES |
COc1ccc(cc1C(N)=O)-c1cncc(c1C)-c1ccc(cc1)N1CCNCC1
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| InChI |
InChI=1S/C24H26N4O2/c1-16-21(17-3-6-19(7-4-17)28-11-9-26-10-12-28)14-27-15-22(16)18-5-8-23(30-2)20(13-18)24(25)29/h3-8,13-15,26H,9-12H2,1-2H3,(H2,25,29)
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| InChIKey |
VWSJHMPASGLSIW-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