General Information of the Compound
| Compound ID |
CP0514215
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| Compound Name |
3-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)pyridine-2-carboxamide
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| Structure |
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| Formula |
C28H31N3O
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| Molecular Weight |
425.576
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| Canonical SMILES |
O=C(NCCCN1CCC2(CCc3ccccc23)CC1)c1ncccc1-c1ccccc1
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| InChI |
InChI=1S/C28H31N3O/c32-27(26-24(11-6-17-29-26)22-8-2-1-3-9-22)30-18-7-19-31-20-15-28(16-21-31)14-13-23-10-4-5-12-25(23)28/h1-6,8-12,17H,7,13-16,18-21H2,(H,30,32)
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| InChIKey |
GVVQWXUGQDMYBR-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