General Information of the Compound
| Compound ID |
CP0496826
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| Compound Name |
2-benzyl-N-(3-{2,3-dihydrospiro[indene-1,4'-piperidine]-1'-yl}propyl)benzamide
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| Structure |
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| Formula |
C30H34N2O
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| Molecular Weight |
438.615
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| Canonical SMILES |
O=C(NCCCN1CCC2(CCc3ccccc23)CC1)c1ccccc1Cc1ccccc1
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| InChI |
InChI=1S/C30H34N2O/c33-29(27-13-6-4-12-26(27)23-24-9-2-1-3-10-24)31-19-8-20-32-21-17-30(18-22-32)16-15-25-11-5-7-14-28(25)30/h1-7,9-14H,8,15-23H2,(H,31,33)
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| InChIKey |
XFIZETUANYXJSD-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