General Information of the Compound
| Compound ID |
CP0399937
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| Compound Name |
(+/-)-3-(1'-(4-bromobenzyl)-2,6-dioxo-3,4'-bipiperidin-3-yl)-N-methyl-N-(piperazin-1-yl)benzamide
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| Structure |
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| Formula |
C29H36BrN5O3
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| Molecular Weight |
582.543
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| Canonical SMILES |
CN(N1CCNCC1)C(=O)c1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
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| InChI |
InChI=1S/C29H36BrN5O3/c1-33(35-17-13-31-14-18-35)27(37)22-3-2-4-24(19-22)29(12-9-26(36)32-28(29)38)23-10-15-34(16-11-23)20-21-5-7-25(30)8-6-21/h2-8,19,23,31H,9-18,20H2,1H3,(H,32,36,38)
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| InChIKey |
NHKQPTYZGHQVNO-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