General Information of the Compound
| Compound ID |
CP0181646
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| Compound Name |
5-(2-(1,4'-bipiperidin-1'-yl)thiazolo[4,5-b]pyridin-6-yl)nicotinonitrile
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| Structure |
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| Formula |
C22H24N6S
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| Molecular Weight |
404.543
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| Canonical SMILES |
N#Cc1cncc(c1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
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| InChI |
InChI=1S/C22H24N6S/c23-12-16-10-17(14-24-13-16)18-11-20-21(25-15-18)26-22(29-20)28-8-4-19(5-9-28)27-6-2-1-3-7-27/h10-11,13-15,19H,1-9H2
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| InChIKey |
NVAWRPKZEOSLKX-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