General Information of the Compound
| Compound ID |
CP0452470
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| Compound Name |
3-bromo-6-[3-(dimethylamino)propyl]indeno[1,2-c]isoquinoline-5,11-dione
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| Structure |
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| Formula |
C21H19BrN2O2
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| Molecular Weight |
411.299
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| Canonical SMILES |
CN(C)CCCn1c2-c3ccccc3C(=O)c2c2ccc(Br)cc2c1=O
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| InChI |
InChI=1S/C21H19BrN2O2/c1-23(2)10-5-11-24-19-15-6-3-4-7-16(15)20(25)18(19)14-9-8-13(22)12-17(14)21(24)26/h3-4,6-9,12H,5,10-11H2,1-2H3
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| InChIKey |
FOBXSBZQRHITTL-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