General Information of the Compound
| Compound ID |
CP0545328
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| Compound Name |
2-[4-(Quinolin-2-ylmethoxy)-phenyl]-N-[4-(1H-tetrazol-5-yl)-benzyl]-acetamide
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| Structure |
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| Formula |
C26H22N6O2
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| Molecular Weight |
450.502
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| Canonical SMILES |
O=C(Cc1ccc(OCc2ccc3ccccc3n2)cc1)NCc1ccc(cc1)-c1nnn[nH]1
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| InChI |
InChI=1S/C26H22N6O2/c33-25(27-16-19-5-9-21(10-6-19)26-29-31-32-30-26)15-18-7-13-23(14-8-18)34-17-22-12-11-20-3-1-2-4-24(20)28-22/h1-14H,15-17H2,(H,27,33)(H,29,30,31,32)
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| InChIKey |
VUYVXGRLPPOJEX-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