General Information of the Compound
| Compound ID |
CP0284392
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| Compound Name |
Benzodioxole deriv. 18
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| Structure |
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| Formula |
C23H26N4O5
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| Molecular Weight |
438.484
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| Canonical SMILES |
COc1cc2c(Nc3cccc4OCOc34)ncnc2cc1OCCCN1CCOCC1
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| InChI |
InChI=1S/C23H26N4O5/c1-28-20-12-16-18(13-21(20)30-9-3-6-27-7-10-29-11-8-27)24-14-25-23(16)26-17-4-2-5-19-22(17)32-15-31-19/h2,4-5,12-14H,3,6-11,15H2,1H3,(H,24,25,26)
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| InChIKey |
LCMNOZWTNCADQP-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