General Information of the Compound
| Compound ID |
CP0501173
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| Compound Name |
2-((E)-2-Anthracen-9-yl-vinyl)-1-methyl-piperidine
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| Structure |
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| Formula |
C22H23N
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| Molecular Weight |
301.433
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| Canonical SMILES |
CN1CCCCC1\C=C\c1c2ccccc2cc2ccccc12
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| InChI |
InChI=1S/C22H23N/c1-23-15-7-6-10-19(23)13-14-22-20-11-4-2-8-17(20)16-18-9-3-5-12-21(18)22/h2-5,8-9,11-14,16,19H,6-7,10,15H2,1H3/b14-13+
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| InChIKey |
HSNXYFHBWRGJNE-BUHFOSPRSA-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