General Information of the Compound
| Compound ID |
CP0564253
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| Compound Name |
propan-2-yl 5-cyano-4-(3-ethylquinolin-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate
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| Structure |
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| Formula |
C23H25N3O2
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| Molecular Weight |
375.472
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| Canonical SMILES |
CCc1cnc2cccc(C3C(C#N)=C(C)NC(C)=C3C(=O)OC(C)C)c2c1
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| InChI |
InChI=1S/C23H25N3O2/c1-6-16-10-18-17(8-7-9-20(18)25-12-16)22-19(11-24)14(4)26-15(5)21(22)23(27)28-13(2)3/h7-10,12-13,22,26H,6H2,1-5H3
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| InChIKey |
VOEYZQBGJPXFOP-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