General Information of the Compound
| Compound ID |
CP0437567
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| Compound Name |
6-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-2-pyridin-2-ylpyridazin-3-one
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| Structure |
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| Formula |
C24H26N4O2
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| Molecular Weight |
402.498
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| Canonical SMILES |
O=c1ccc(nn1-c1ccccn1)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
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| InChI |
InChI=1S/C24H26N4O2/c29-24-12-11-22(26-28(24)23-6-1-2-15-25-23)18-7-9-20(10-8-18)30-21-13-16-27(17-14-21)19-4-3-5-19/h1-2,6-12,15,19,21H,3-5,13-14,16-17H2
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| InChIKey |
GDRKISYBEKBJNO-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