General Information of the Compound
| Compound ID |
CP0390297
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| Compound Name |
(3S)-3-[4-[[3-(2,4-dichlorophenyl)phenyl]methoxy]phenyl]-3-(1-methylimidazol-2-yl)propanoic acid
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| Structure |
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| Formula |
C26H22Cl2N2O3
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| Molecular Weight |
481.379
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| Canonical SMILES |
Cn1ccnc1[C@@H](CC(O)=O)c1ccc(OCc2cccc(c2)-c2ccc(Cl)cc2Cl)cc1
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| InChI |
InChI=1S/C26H22Cl2N2O3/c1-30-12-11-29-26(30)23(15-25(31)32)18-5-8-21(9-6-18)33-16-17-3-2-4-19(13-17)22-10-7-20(27)14-24(22)28/h2-14,23H,15-16H2,1H3,(H,31,32)/t23-/m0/s1
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| InChIKey |
ICWFXWVWFUYWBI-QHCPKHFHSA-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