General Information of the Compound
| Compound ID |
CP0958093
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| Compound Name |
1'-(2-(4-isopropoxyphenyl)-2-(4-(2-methoxyethyl)piperazin-1-yl)ethyl)-1,4'-bipiperidine
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| Structure |
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| Formula |
C28H48N4O2
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| Molecular Weight |
472.718
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| Canonical SMILES |
COCCN1CCN(C(CN2CCC(N3CCCCC3)CC2)c2ccc(OC(C)C)cc2)CC1
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| InChI |
InChI=1S/C28H48N4O2/c1-24(2)34-27-9-7-25(8-10-27)28(32-19-17-29(18-20-32)21-22-33-3)23-30-15-11-26(12-16-30)31-13-5-4-6-14-31/h7-10,24,26,28H,4-6,11-23H2,1-3H3
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| InChIKey |
IJXZYAXTMSZRGP-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