General Information of the Compound
| Compound ID |
CP0402434
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| Compound Name |
(R)-2-(4-((2-(7-(quinolin-2-ylmethoxy)naphthalen-2-yl)propanamido)methyl)phenyl)acetic acid
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| Structure |
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| Formula |
C32H28N2O4
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| Molecular Weight |
504.586
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| Canonical SMILES |
C[C@@H](C(=O)NCc1ccc(CC(O)=O)cc1)c1ccc2ccc(OCc3ccc4ccccc4n3)cc2c1
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| InChI |
InChI=1S/C32H28N2O4/c1-21(32(37)33-19-23-8-6-22(7-9-23)16-31(35)36)26-11-10-24-13-15-29(18-27(24)17-26)38-20-28-14-12-25-4-2-3-5-30(25)34-28/h2-15,17-18,21H,16,19-20H2,1H3,(H,33,37)(H,35,36)/t21-/m1/s1
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| InChIKey |
FNARGUMACODUNI-OAQYLSRUSA-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