General Information of the Compound
| Compound ID |
CP0557913
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| Compound Name |
(2S)-N-[(1R)-2-hydroxy-1-[4-[(2S)-2-methoxypropoxy]phenyl]ethyl]-2-phenylpropanamide
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| Structure |
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| Formula |
C21H27NO4
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| Molecular Weight |
357.45
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| Canonical SMILES |
CO[C@@H](C)COc1ccc(cc1)[C@H](CO)NC(=O)[C@@H](C)c1ccccc1
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| InChI |
InChI=1S/C21H27NO4/c1-15(25-3)14-26-19-11-9-18(10-12-19)20(13-23)22-21(24)16(2)17-7-5-4-6-8-17/h4-12,15-16,20,23H,13-14H2,1-3H3,(H,22,24)/t15-,16-,20-/m0/s1
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| InChIKey |
BRWPSTTYRIHGBA-FTRWYGJKSA-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