General Information of the Compound
| Compound ID |
CP0404862
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| Compound Name |
(3,3-difluorocyclobutyl)-[2-[2-(4-fluorophenyl)ethynyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl]methanone
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| Structure |
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| Formula |
C19H15F3N2OS
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| Molecular Weight |
376.403
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| Canonical SMILES |
Fc1ccc(cc1)C#Cc1nc2CCN(Cc2s1)C(=O)C1CC(F)(F)C1
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| InChI |
InChI=1S/C19H15F3N2OS/c20-14-4-1-12(2-5-14)3-6-17-23-15-7-8-24(11-16(15)26-17)18(25)13-9-19(21,22)10-13/h1-2,4-5,13H,7-11H2
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| InChIKey |
DYYLIXFEKVRKRW-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