General Information of the Compound
| Compound ID |
CP0443538
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| Compound Name |
[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-[4-[4-[(4-methylpiperazin-1-yl)methyl]phenoxy]piperidin-1-yl]methanone
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| Structure |
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| Formula |
C27H33N5O4
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| Molecular Weight |
491.592
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| Canonical SMILES |
COc1ccc(cc1)-c1nnc(o1)C(=O)N1CCC(CC1)Oc1ccc(CN2CCN(C)CC2)cc1
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| InChI |
InChI=1S/C27H33N5O4/c1-30-15-17-31(18-16-30)19-20-3-7-23(8-4-20)35-24-11-13-32(14-12-24)27(33)26-29-28-25(36-26)21-5-9-22(34-2)10-6-21/h3-10,24H,11-19H2,1-2H3
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| InChIKey |
FEVDGOBPECQEPO-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