General Information of the Compound
| Compound ID |
CP0407646
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| Compound Name |
(2S)-2-amino-3-(3-benzylphenyl)propanoic acid
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| Structure |
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| Formula |
C16H17NO2
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| Molecular Weight |
255.317
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| Canonical SMILES |
N[C@@H](Cc1cccc(Cc2ccccc2)c1)C(O)=O
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| InChI |
InChI=1S/C16H17NO2/c17-15(16(18)19)11-14-8-4-7-13(10-14)9-12-5-2-1-3-6-12/h1-8,10,15H,9,11,17H2,(H,18,19)/t15-/m0/s1
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| InChIKey |
WDAJRFDYHJVFMA-HNNXBMFYSA-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