General Information of the Compound
| Compound ID |
CP0470803
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| Compound Name |
5-[4-(3-imidazol-1-ylpropylamino)-6-(4-methoxyphenyl)quinolin-3-yl]-1,3,4-oxadiazol-2-amine
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| Structure |
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| Formula |
C24H23N7O2
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| Molecular Weight |
441.495
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| Canonical SMILES |
COc1ccc(cc1)-c1ccc2ncc(-c3nnc(N)o3)c(NCCCn3ccnc3)c2c1
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| InChI |
InChI=1S/C24H23N7O2/c1-32-18-6-3-16(4-7-18)17-5-8-21-19(13-17)22(27-9-2-11-31-12-10-26-15-31)20(14-28-21)23-29-30-24(25)33-23/h3-8,10,12-15H,2,9,11H2,1H3,(H2,25,30)(H,27,28)
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| InChIKey |
IMTMHWAXSZULPV-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