General Information of the Compound
| Compound ID |
CP0901648
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| Compound Name |
7-Morpholin-4-ylmethyl-8-(3,4,5-trimethoxybenzyloxy)-quinoline
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| Structure |
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| Formula |
C24H28N2O5
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| Molecular Weight |
424.497
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| Canonical SMILES |
COc1cc(COc2c(CN3CCOCC3)ccc3cccnc23)cc(OC)c1OC
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| InChI |
InChI=1S/C24H28N2O5/c1-27-20-13-17(14-21(28-2)24(20)29-3)16-31-23-19(15-26-9-11-30-12-10-26)7-6-18-5-4-8-25-22(18)23/h4-8,13-14H,9-12,15-16H2,1-3H3
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| InChIKey |
YHPSVXTWXMPIRC-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