General Information of the Compound
| Compound ID |
CP0141367
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| Compound Name |
1,3-Dichloro-2-methoxy-7-methyl-5,6,7,8,9,14-hexahydrodibenzo[d,g]azecine
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| Structure |
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| Formula |
C19H21Cl2NO
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| Molecular Weight |
350.289
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| Canonical SMILES |
COc1c(Cl)cc2CCN(C)CCc3ccccc3Cc2c1Cl
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| InChI |
InChI=1S/C19H21Cl2NO/c1-22-9-7-13-5-3-4-6-14(13)11-16-15(8-10-22)12-17(20)19(23-2)18(16)21/h3-6,12H,7-11H2,1-2H3
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| InChIKey |
MYFHADFSNRZMLH-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