General Information of the Compound
| Compound ID |
CP0523449
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| Compound Name |
2-benzyl-7-(3-methoxyphenyl)-1,3,4,5-tetrahydro-2-benzazepine
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| Structure |
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| Formula |
C24H25NO
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| Molecular Weight |
343.47
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| Canonical SMILES |
COc1cccc(c1)-c1ccc2CN(Cc3ccccc3)CCCc2c1
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| InChI |
InChI=1S/C24H25NO/c1-26-24-11-5-9-21(16-24)22-12-13-23-18-25(14-6-10-20(23)15-22)17-19-7-3-2-4-8-19/h2-5,7-9,11-13,15-16H,6,10,14,17-18H2,1H3
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| InChIKey |
HARWPKOPJYALIX-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