General Information of the Compound
| Compound ID |
CP0456910
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| Compound Name |
9-Benzo[1,3]dioxol-5-ylmethyl-acridine
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| Structure |
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| Formula |
C21H15NO2
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| Molecular Weight |
313.356
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| Canonical SMILES |
C(c1ccc2OCOc2c1)c1c2ccccc2nc2ccccc12
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| InChI |
InChI=1S/C21H15NO2/c1-3-7-18-15(5-1)17(16-6-2-4-8-19(16)22-18)11-14-9-10-20-21(12-14)24-13-23-20/h1-10,12H,11,13H2
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| InChIKey |
ZNIQDBVATXDCBV-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