General Information of the Compound
| Compound ID |
CP0458921
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| Compound Name |
(RS)-3'-(2-Amino-2-carboxyethyl)biphenyl-4-carboxylic acid
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| Structure |
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| Formula |
C16H15NO4
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| Molecular Weight |
285.299
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| Canonical SMILES |
NC(Cc1cccc(c1)-c1ccc(cc1)C(O)=O)C(O)=O
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| InChI |
InChI=1S/C16H15NO4/c17-14(16(20)21)9-10-2-1-3-13(8-10)11-4-6-12(7-5-11)15(18)19/h1-8,14H,9,17H2,(H,18,19)(H,20,21)
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| InChIKey |
ZRPVOFOKCMNDDH-UHFFFAOYSA-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