General Information of the Compound
| Compound ID |
CP0378238
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| Compound Name |
5-(4-Benzhydrylidene-piperidin-1-yl)-2,2-diphenyl-pentanenitrile
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| Structure |
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| Formula |
C35H34N2
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| Molecular Weight |
482.671
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| Canonical SMILES |
N#CC(CCCN1CCC(CC1)=C(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C35H34N2/c36-28-35(32-18-9-3-10-19-32,33-20-11-4-12-21-33)24-13-25-37-26-22-31(23-27-37)34(29-14-5-1-6-15-29)30-16-7-2-8-17-30/h1-12,14-21H,13,22-27H2
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| InChIKey |
QYEKUEKGGGUKAY-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