General Information of the Compound
| Compound ID |
CP0421369
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| Compound Name |
(E)-N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-(4-methoxyphenyl)prop-2-enamide
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| Structure |
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| Formula |
C21H25ClN2O2
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| Molecular Weight |
372.896
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| Canonical SMILES |
COc1ccc(\C=C\C(=O)NC(CCN(C)C)c2ccc(Cl)cc2)cc1
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| InChI |
InChI=1S/C21H25ClN2O2/c1-24(2)15-14-20(17-7-9-18(22)10-8-17)23-21(25)13-6-16-4-11-19(26-3)12-5-16/h4-13,20H,14-15H2,1-3H3,(H,23,25)/b13-6+
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| InChIKey |
ZNDMSFIIKSPGLP-AWNIVKPZSA-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