General Information of the Compound
| Compound ID |
CP0473831
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| Compound Name |
N-[(2S)-3-methylbutan-2-yl]-4-[(propan-2-ylamino)methyl]-5-[4-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
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| Structure |
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| Formula |
C20H26F3N3O2
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| Molecular Weight |
397.441
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| Canonical SMILES |
CC(C)NCc1c(noc1-c1ccc(cc1)C(F)(F)F)C(=O)N[C@@H](C)C(C)C
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| InChI |
InChI=1S/C20H26F3N3O2/c1-11(2)13(5)25-19(27)17-16(10-24-12(3)4)18(28-26-17)14-6-8-15(9-7-14)20(21,22)23/h6-9,11-13,24H,10H2,1-5H3,(H,25,27)/t13-/m0/s1
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| InChIKey |
JTRMDEAPHOUQLT-ZDUSSCGKSA-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