General Information of the Compound
| Compound ID |
CP0419776
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| Compound Name |
[2-(4-methoxyphenyl)-8-thiophen-2-ylquinolin-4-yl]-morpholin-4-ylmethanone
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| Formula |
C25H22N2O3S
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| Molecular Weight |
430.529
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| Canonical SMILES |
COc1ccc(cc1)-c1cc(C(=O)N2CCOCC2)c2cccc(-c3cccs3)c2n1
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| InChI |
InChI=1S/C25H22N2O3S/c1-29-18-9-7-17(8-10-18)22-16-21(25(28)27-11-13-30-14-12-27)19-4-2-5-20(24(19)26-22)23-6-3-15-31-23/h2-10,15-16H,11-14H2,1H3
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| InChIKey |
BPJCSSURXYITEW-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