General Information of the Compound
| Compound ID |
CP0469393
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| Compound Name |
(4-fluoro-4-(((5-methylpyridin-2-yl)methylamino)methyl)piperidin-1-yl)(4-methoxythiophen-3-yl)methanone
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| Structure |
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| Formula |
C19H24FN3O2S
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| Molecular Weight |
377.485
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| Canonical SMILES |
COc1cscc1C(=O)N1CCC(F)(CNCc2ccc(C)cn2)CC1
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| InChI |
InChI=1S/C19H24FN3O2S/c1-14-3-4-15(22-9-14)10-21-13-19(20)5-7-23(8-6-19)18(24)16-11-26-12-17(16)25-2/h3-4,9,11-12,21H,5-8,10,13H2,1-2H3
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| InChIKey |
DIFUMFTVPWYGTD-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