General Information of the Compound
| Compound ID |
CP0558121
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| Compound Name |
(2S)-N-[(R)-(5-methyl-1,3,4-oxadiazol-2-yl)-[4-(2-methylpentoxy)phenyl]methyl]-2-phenylpropanamide
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| Formula |
C25H31N3O3
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| Molecular Weight |
421.541
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| Canonical SMILES |
CCCC(C)COc1ccc(cc1)[C@@H](NC(=O)[C@@H](C)c1ccccc1)c1nnc(C)o1
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| InChI |
InChI=1S/C25H31N3O3/c1-5-9-17(2)16-30-22-14-12-21(13-15-22)23(25-28-27-19(4)31-25)26-24(29)18(3)20-10-7-6-8-11-20/h6-8,10-15,17-18,23H,5,9,16H2,1-4H3,(H,26,29)/t17?,18-,23+/m0/s1
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| InChIKey |
WALKXIJLDRMJNF-KICWZURGSA-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