General Information of the Compound
| Compound ID |
CP0556735
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| Compound Name |
6-(4-methoxyphenyl)-3-(1,3,4-oxadiazol-2-yl)-N-(3-pyrrol-1-ylpropyl)quinolin-4-amine
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| Structure |
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| Formula |
C25H23N5O2
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| Molecular Weight |
425.492
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| Canonical SMILES |
COc1ccc(cc1)-c1ccc2ncc(-c3nnco3)c(NCCCn3cccc3)c2c1
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| InChI |
InChI=1S/C25H23N5O2/c1-31-20-8-5-18(6-9-20)19-7-10-23-21(15-19)24(22(16-27-23)25-29-28-17-32-25)26-11-4-14-30-12-2-3-13-30/h2-3,5-10,12-13,15-17H,4,11,14H2,1H3,(H,26,27)
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| InChIKey |
MYANQKPFWWQTRW-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