General Information of the Compound
| Compound ID |
CP0516366
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| Compound Name |
(R)-2-[3-cyano-2-(2'-ethoxy-biphenyl-4-yl)-6-methoxy-quinolin-4-ylamino]-propionic acid
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| Structure |
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| Formula |
C28H25N3O4
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| Molecular Weight |
467.525
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| Canonical SMILES |
CCOc1ccccc1-c1ccc(cc1)-c1nc2ccc(OC)cc2c(N[C@H](C)C(O)=O)c1C#N
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| InChI |
InChI=1S/C28H25N3O4/c1-4-35-25-8-6-5-7-21(25)18-9-11-19(12-10-18)26-23(16-29)27(30-17(2)28(32)33)22-15-20(34-3)13-14-24(22)31-26/h5-15,17H,4H2,1-3H3,(H,30,31)(H,32,33)/t17-/m1/s1
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| InChIKey |
WWGFSMUKANMFED-QGZVFWFLSA-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