General Information of the Compound
| Compound ID |
CP0135080
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| Compound Name |
2,2-diphenyl-4-piperidin-1-ylbutanenitrile
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| Structure |
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| Formula |
C21H24N2
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| Molecular Weight |
304.437
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| Canonical SMILES |
N#CC(CCN1CCCCC1)(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C21H24N2/c22-18-21(19-10-4-1-5-11-19,20-12-6-2-7-13-20)14-17-23-15-8-3-9-16-23/h1-2,4-7,10-13H,3,8-9,14-17H2
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| InChIKey |
VXPUAJALRVCLNP-UHFFFAOYSA-N
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| CAS |
5424-08-8
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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