General Information of the Compound
| Compound ID |
CP0374899
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| Compound Name |
Acridin-9-yl-benzo[1,3]dioxol-5-yl-acetic acid 4-methoxy-benzyl ester
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| Structure |
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| Formula |
C30H23NO5
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| Molecular Weight |
477.516
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| Canonical SMILES |
COc1ccc(COC(=O)C(c2ccc3OCOc3c2)c2c3ccccc3nc3ccccc23)cc1
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| InChI |
InChI=1S/C30H23NO5/c1-33-21-13-10-19(11-14-21)17-34-30(32)28(20-12-15-26-27(16-20)36-18-35-26)29-22-6-2-4-8-24(22)31-25-9-5-3-7-23(25)29/h2-16,28H,17-18H2,1H3
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| InChIKey |
XRBYSZSXEPYWSC-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