General Information of the Compound
| Compound ID |
CP0387943
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| Compound Name |
N-[2-(4-methoxyphenyl)ethyl]benzo[b][1]benzazepine-11-carboxamide
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| Structure |
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| Formula |
C24H22N2O2
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| Molecular Weight |
370.452
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| Canonical SMILES |
COc1ccc(CCNC(=O)N2c3ccccc3C=Cc3ccccc23)cc1
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| InChI |
InChI=1S/C24H22N2O2/c1-28-21-14-10-18(11-15-21)16-17-25-24(27)26-22-8-4-2-6-19(22)12-13-20-7-3-5-9-23(20)26/h2-15H,16-17H2,1H3,(H,25,27)
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| InChIKey |
ZFQCEMBADSQEEZ-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