General Information of the Compound
| Compound ID |
CP0571024
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| Compound Name |
(E)-3-[4-(dimethylamino)phenyl]-1-[2-hydroxy-4,6-dimethoxy-3-(3-methylbut-2-enyl)phenyl]prop-2-en-1-one
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| Structure |
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| Formula |
C24H29NO4
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| Molecular Weight |
395.499
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| Canonical SMILES |
COc1cc(OC)c(C(=O)\C=C\c2ccc(cc2)N(C)C)c(O)c1CC=C(C)C
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| InChI |
InChI=1S/C24H29NO4/c1-16(2)7-13-19-21(28-5)15-22(29-6)23(24(19)27)20(26)14-10-17-8-11-18(12-9-17)25(3)4/h7-12,14-15,27H,13H2,1-6H3/b14-10+
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| InChIKey |
HSFXRTBLDWBKAW-GXDHUFHOSA-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