General Information of the Compound
| Compound ID |
CP0488287
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| Compound Name |
6-[6-(1-cyclobutylpiperidin-4-yl)oxypyridin-3-yl]-2-propan-2-ylpyridazin-3-one
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| Structure |
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| Formula |
C21H28N4O2
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| Molecular Weight |
368.481
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| Canonical SMILES |
CC(C)n1nc(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCC2)nc1
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| InChI |
InChI=1S/C21H28N4O2/c1-15(2)25-21(26)9-7-19(23-25)16-6-8-20(22-14-16)27-18-10-12-24(13-11-18)17-4-3-5-17/h6-9,14-15,17-18H,3-5,10-13H2,1-2H3
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| InChIKey |
AZFRDBSLRWKFPY-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: PT01194, Histamine H3 receptor
Protein ID: PT01173, Histamine H3 receptor