General Information of the Compound
| Compound ID |
CP0456273
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| Compound Name |
2-(2-fluorophenyl)-5-(1-phenylcyclopropyl)-[1,3]thiazolo[5,4-b]pyridine
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| Structure |
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| Formula |
C21H15FN2S
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| Molecular Weight |
346.43
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| Canonical SMILES |
Fc1ccccc1-c1nc2ccc(nc2s1)C1(CC1)c1ccccc1
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| InChI |
InChI=1S/C21H15FN2S/c22-16-9-5-4-8-15(16)19-23-17-10-11-18(24-20(17)25-19)21(12-13-21)14-6-2-1-3-7-14/h1-11H,12-13H2
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| InChIKey |
DCBBXRFSJCTLPY-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: PT01688, Sphingosine 1-phosphate receptor 1
Protein ID: PT01838, Sphingosine 1-phosphate receptor 3