General Information of the Compound
| Compound ID |
CP0244795
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| Compound Name |
14-bromo-18-(prop-2-en-1-yl)-8,18-diazatetracyclo[9.7.0.0^{2,7}.0^{12,17}]octadeca-1(11),2,4,6,12(17),13,15-heptaen-9-one
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| Structure |
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| Formula |
C19H15BrN2O
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| Molecular Weight |
367.246
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| Canonical SMILES |
Brc1ccc2n(CC=C)c-3c(CC(=O)Nc4ccccc-34)c2c1
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| InChI |
InChI=1S/C19H15BrN2O/c1-2-9-22-17-8-7-12(20)10-14(17)15-11-18(23)21-16-6-4-3-5-13(16)19(15)22/h2-8,10H,1,9,11H2,(H,21,23)
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| InChIKey |
GJZCFRVBDYYNIV-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