General Information of the Compound
| Compound ID |
CP0265676
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| Compound Name |
N-(2-adamantyl)-4-bromo-1-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
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| Structure |
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| Formula |
C26H35BrN2O2
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| Molecular Weight |
487.482
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| Canonical SMILES |
OCCC1CC2(CCN(CC2)C(=O)NC2C3CC4CC(C3)CC2C4)c2c1cccc2Br
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| InChI |
InChI=1S/C26H35BrN2O2/c27-22-3-1-2-21-18(4-9-30)15-26(23(21)22)5-7-29(8-6-26)25(31)28-24-19-11-16-10-17(13-19)14-20(24)12-16/h1-3,16-20,24,30H,4-15H2,(H,28,31)
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| InChIKey |
FIAGRZHTDXBMMS-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