General Information of the Compound
| Compound ID |
CP0490691
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| Compound Name |
2-(2'-(((benzyloxycarbonyl)(ethyl)amino)methyl)-4'-(2-hydroxypropan-2-yl)-6-methoxybiphenyl-3-yl)acetic acid
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| Structure |
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| Formula |
C29H33NO6
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| Molecular Weight |
491.584
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| Canonical SMILES |
CCN(Cc1cc(ccc1-c1cc(CC(O)=O)ccc1OC)C(C)(C)O)C(=O)OCc1ccccc1
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| InChI |
InChI=1S/C29H33NO6/c1-5-30(28(33)36-19-20-9-7-6-8-10-20)18-22-17-23(29(2,3)34)12-13-24(22)25-15-21(16-27(31)32)11-14-26(25)35-4/h6-15,17,34H,5,16,18-19H2,1-4H3,(H,31,32)
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| InChIKey |
VVGOJQDCPYQQQU-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