General Information of the Compound
| Compound ID |
CP0440269
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| Compound Name |
2-[(E)-3-(9,10-Dihydro-anthracen-9-yl)-allyl]-1-methyl-piperidine
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| Structure |
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| Formula |
C23H27N
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| Molecular Weight |
317.476
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| Canonical SMILES |
CN1CCCCC1C\C=C\C1c2ccccc2Cc2ccccc12
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| InChI |
InChI=1S/C23H27N/c1-24-16-7-6-11-20(24)12-8-15-23-21-13-4-2-9-18(21)17-19-10-3-5-14-22(19)23/h2-5,8-10,13-15,20,23H,6-7,11-12,16-17H2,1H3/b15-8+
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| InChIKey |
YAINNLXCRMBIAC-OVCLIPMQSA-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