General Information of the Compound
| Compound ID |
CP0570046
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| Compound Name |
N-[2-[2-[4-[2-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)ethyl]phenyl]tetrazol-5-yl]-5-methoxy-4-phenylmethoxyphenyl]-4-oxochromene-2-carboxamide
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| Formula |
C41H35N7O5
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| Molecular Weight |
705.775
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| Canonical SMILES |
COc1cc(NC(=O)c2cc(=O)c3ccccc3o2)c(cc1OCc1ccccc1)-c1nnn(n1)-c1ccc(CCN2CCc3cnccc3C2)cc1
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| InChI |
InChI=1S/C41H35N7O5/c1-51-37-22-34(43-41(50)39-23-35(49)32-9-5-6-10-36(32)53-39)33(21-38(37)52-26-28-7-3-2-4-8-28)40-44-46-48(45-40)31-13-11-27(12-14-31)16-19-47-20-17-29-24-42-18-15-30(29)25-47/h2-15,18,21-24H,16-17,19-20,25-26H2,1H3,(H,43,50)
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| InChIKey |
RZBYWYQCFTUDRA-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