General Information of the Compound
| Compound ID |
CP0519303
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| Compound Name |
N-[(1R)-2-hydroxy-1-[4-(2-methylpentoxy)phenyl]ethyl]-2-phenylacetamide
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| Structure |
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| Formula |
C22H29NO3
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| Molecular Weight |
355.478
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| Canonical SMILES |
CCCC(C)COc1ccc(cc1)[C@H](CO)NC(=O)Cc1ccccc1
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| InChI |
InChI=1S/C22H29NO3/c1-3-7-17(2)16-26-20-12-10-19(11-13-20)21(15-24)23-22(25)14-18-8-5-4-6-9-18/h4-6,8-13,17,21,24H,3,7,14-16H2,1-2H3,(H,23,25)/t17?,21-/m0/s1
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| InChIKey |
WKYNMPQSWSISJD-LFABVHOISA-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