General Information of the Compound
| Compound ID |
CP0554596
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| Compound Name |
N-(1-cyclobutylpiperidin-4-yl)-5-(2,4-difluorophenyl)-1,2-oxazole-3-carboxamide
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| Formula |
C19H21F2N3O2
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| Molecular Weight |
361.392
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| Canonical SMILES |
Fc1ccc(-c2cc(no2)C(=O)NC2CCN(CC2)C2CCC2)c(F)c1
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| InChI |
InChI=1S/C19H21F2N3O2/c20-12-4-5-15(16(21)10-12)18-11-17(23-26-18)19(25)22-13-6-8-24(9-7-13)14-2-1-3-14/h4-5,10-11,13-14H,1-3,6-9H2,(H,22,25)
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| InChIKey |
OJTKDBPCIMYQNO-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