General Information of the Compound
| Compound ID |
CP0371830
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| Compound Name |
2-(6-(Pyrimidine-5-yl)oxazolo[4,5-b]pyridin-2-yl)-2,5-diazabicyclo[3.2.2]nonane
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| Structure |
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| Formula |
C17H18N6O
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| Molecular Weight |
322.372
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| Canonical SMILES |
C1CN2CCC1N(CC2)c1nc2ncc(cc2o1)-c1cncnc1
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| InChI |
InChI=1S/C17H18N6O/c1-3-22-4-2-14(1)23(6-5-22)17-21-16-15(24-17)7-12(10-20-16)13-8-18-11-19-9-13/h7-11,14H,1-6H2
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| InChIKey |
UHVCBLPINYVBIX-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: PT03697, 5-hydroxytryptamine receptor 3A
Protein ID: PT02118, Neuronal acetylcholine receptor subunit alpha-7