General Information of the Compound
| Compound ID |
CP0577987
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| Compound Name |
ethyl 11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,8,15-hexaene-12-carboxylate
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| Formula |
C19H19NO2
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| Molecular Weight |
293.366
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| Canonical SMILES |
CCOC(=O)C1Nc2ccc3ccccc3c2C2C=CCC12
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| InChI |
InChI=1S/C19H19NO2/c1-2-22-19(21)18-15-9-5-8-14(15)17-13-7-4-3-6-12(13)10-11-16(17)20-18/h3-8,10-11,14-15,18,20H,2,9H2,1H3
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| InChIKey |
NQVUPVVWXKBKRE-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