General Information of the Compound
| Compound ID |
CP0423663
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| Compound Name |
(2S)-2-amino-3-[3-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]propanoic acid
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| Structure |
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| Formula |
C14H19NO4
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| Molecular Weight |
265.309
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| Canonical SMILES |
CC(C)(C)OC(=O)c1cccc(C[C@H](N)C(O)=O)c1
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| InChI |
InChI=1S/C14H19NO4/c1-14(2,3)19-13(18)10-6-4-5-9(7-10)8-11(15)12(16)17/h4-7,11H,8,15H2,1-3H3,(H,16,17)/t11-/m0/s1
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| InChIKey |
ZFAGSQFMGXPASJ-NSHDSACASA-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