General Information of the Compound
| Compound ID |
CP0456980
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| Compound Name |
Acridin-9-yl-benzo[1,3]dioxol-5-yl-acetic acid methyl ester
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| Structure |
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| Formula |
C23H17NO4
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| Molecular Weight |
371.392
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| Canonical SMILES |
COC(=O)C(c1ccc2OCOc2c1)c1c2ccccc2nc2ccccc12
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| InChI |
InChI=1S/C23H17NO4/c1-26-23(25)21(14-10-11-19-20(12-14)28-13-27-19)22-15-6-2-4-8-17(15)24-18-9-5-3-7-16(18)22/h2-12,21H,13H2,1H3
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| InChIKey |
OOTHGTPTLCSOEZ-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