General Information of the Compound
| Compound ID |
CP0578963
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| Compound Name |
4-[3-[[6-methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)-1-benzofuran-4-yl]oxymethyl]phenyl]morpholine
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| Structure |
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| Formula |
C25H24N4O5S
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| Molecular Weight |
492.557
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| Canonical SMILES |
COc1nn2cc(nc2s1)-c1cc2c(OCc3cccc(c3)N3CCOCC3)cc(OC)cc2o1
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| InChI |
InChI=1S/C25H24N4O5S/c1-30-18-11-21(33-15-16-4-3-5-17(10-16)28-6-8-32-9-7-28)19-13-23(34-22(19)12-18)20-14-29-24(26-20)35-25(27-29)31-2/h3-5,10-14H,6-9,15H2,1-2H3
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| InChIKey |
HYDXGRXUZGMNIU-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