General Information of the Compound
| Compound ID |
CP0498368
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| Compound Name |
(5-methoxy-6-pyridin-4-yl-1H-indazol-3-yl)-(4-methylpiperazin-1-yl)methanone
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| Formula |
C19H21N5O2
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| Molecular Weight |
351.41
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| Canonical SMILES |
COc1cc2c(n[nH]c2cc1-c1ccncc1)C(=O)N1CCN(C)CC1
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| InChI |
InChI=1S/C19H21N5O2/c1-23-7-9-24(10-8-23)19(25)18-15-12-17(26-2)14(11-16(15)21-22-18)13-3-5-20-6-4-13/h3-6,11-12H,7-10H2,1-2H3,(H,21,22)
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| InChIKey |
IOMWELPPYPWWGO-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