General Information of the Compound
| Compound ID |
CP0537170
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| Compound Name |
2-(azetidin-1-ylmethyl)-7-(4-fluorophenyl)thieno[3,2-b]pyridine-5-carboxamide
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| Structure |
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| Formula |
C18H16FN3OS
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| Molecular Weight |
341.411
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| Canonical SMILES |
NC(=O)c1cc(-c2ccc(F)cc2)c2sc(CN3CCC3)cc2n1
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| InChI |
InChI=1S/C18H16FN3OS/c19-12-4-2-11(3-5-12)14-9-16(18(20)23)21-15-8-13(24-17(14)15)10-22-6-1-7-22/h2-5,8-9H,1,6-7,10H2,(H2,20,23)
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| InChIKey |
SUWGTABERSAOJQ-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