General Information of the Compound
| Compound ID |
CP0874087
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| Compound Name |
3-(1-(3-chloro-5-(4-(pyridin-4-yl)styryl)phenyl)-2-methylprop-1-enyl)pyridine
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| Structure |
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| Formula |
C28H23ClN2
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| Molecular Weight |
422.959
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| Canonical SMILES |
CC(C)=C(c1cccnc1)c1cc(Cl)cc(/C=C/c2ccc(-c3ccncc3)cc2)c1
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| InChI |
InChI=1S/C28H23ClN2/c1-20(2)28(25-4-3-13-31-19-25)26-16-22(17-27(29)18-26)6-5-21-7-9-23(10-8-21)24-11-14-30-15-12-24/h3-19H,1-2H3/b6-5+
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| InChIKey |
CWAMCYWRYZAFOX-AATRIKPKSA-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