General Information of the Compound
| Compound ID |
CP0731354
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| Compound Name |
(2S)-2-acetamido-3-(2-oxoindolin-3-yl)propanoic acid
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| Structure |
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| Formula |
C13H14N2O4
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| Molecular Weight |
262.265
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| Canonical SMILES |
CC(=O)N[C@@H](CC1C(=O)Nc2ccccc21)C(=O)O
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| InChI |
InChI=1S/C13H14N2O4/c1-7(16)14-11(13(18)19)6-9-8-4-2-3-5-10(8)15-12(9)17/h2-5,9,11H,6H2,1H3,(H,14,16)(H,15,17)(H,18,19)/t9?,11-/m0/s1
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| InChIKey |
RXIDFFRBAOKORP-UMJHXOGRSA-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