General Information of the Compound
| Compound ID |
CP0393725
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| Compound Name |
propan-2-yl 5-acetyl-2,6-dimethyl-4-(2-methyl-4-oxochromen-8-yl)-1,4-dihydropyridine-3-carboxylate
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| Structure |
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| Formula |
C23H25NO5
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| Molecular Weight |
395.455
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| Canonical SMILES |
CC(C)OC(=O)C1=C(C)NC(C)=C(C1c1cccc2c1oc(C)cc2=O)C(C)=O
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| InChI |
InChI=1S/C23H25NO5/c1-11(2)28-23(27)20-14(5)24-13(4)19(15(6)25)21(20)17-9-7-8-16-18(26)10-12(3)29-22(16)17/h7-11,21,24H,1-6H3
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| InChIKey |
ZCFHOWPYJCIUIY-UHFFFAOYSA-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