General Information of the Compound
| Compound ID |
CP0900091
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| Compound Name |
2-(1,4'-bipiperidin-1'-yl)-N-(4-methoxybenzyl)-1-phenylethanamine
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| Structure |
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| Formula |
C26H37N3O
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| Molecular Weight |
407.602
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| Canonical SMILES |
COc1ccc(CNC(CN2CCC(N3CCCCC3)CC2)c2ccccc2)cc1
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| InChI |
InChI=1S/C26H37N3O/c1-30-25-12-10-22(11-13-25)20-27-26(23-8-4-2-5-9-23)21-28-18-14-24(15-19-28)29-16-6-3-7-17-29/h2,4-5,8-13,24,26-27H,3,6-7,14-21H2,1H3
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| InChIKey |
VJZNTQJUCSGWKO-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