General Information of the Compound
| Compound ID |
CP0540408
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| Compound Name |
2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3,4-dimethyl-6-piperidin-4-yl-9H-carbazole
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| Structure |
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| Formula |
C26H27N5O
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| Molecular Weight |
425.536
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| Canonical SMILES |
COc1cc(cn2ncnc12)-c1cc2[nH]c3ccc(cc3c2c(C)c1C)C1CCNCC1
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| InChI |
InChI=1S/C26H27N5O/c1-15-16(2)25-21-10-18(17-6-8-27-9-7-17)4-5-22(21)30-23(25)12-20(15)19-11-24(32-3)26-28-14-29-31(26)13-19/h4-5,10-14,17,27,30H,6-9H2,1-3H3
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| InChIKey |
KFJDSCWFLGCINB-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
Protein ID: PT02160, Toll-like receptor 7
Protein ID: PT02546, Toll-like receptor 8
Protein ID: PT01922, Toll-like receptor 9