General Information of the Compound
| Compound ID |
CP0571838
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| Compound Name |
cyclobutyl (4R)-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 |
C24H25NO5
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| Molecular Weight |
407.466
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| Canonical SMILES |
CC(=O)C1=C(C)NC(C)=C([C@@H]1c1cccc2c1oc(C)cc2=O)C(=O)OC1CCC1
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| InChI |
InChI=1S/C24H25NO5/c1-12-11-19(27)17-9-6-10-18(23(17)29-12)22-20(15(4)26)13(2)25-14(3)21(22)24(28)30-16-7-5-8-16/h6,9-11,16,22,25H,5,7-8H2,1-4H3/t22-/m1/s1
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| InChIKey |
YZENNHFCBHOUSM-JOCHJYFZSA-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