General Information of the Compound
| Compound ID |
CP0275781
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| Compound Name |
(2S)-2-amino-N-(4-nitrophenyl)propanamide
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| Structure |
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| Formula |
C9H11N3O3
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| Molecular Weight |
209.205
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| Canonical SMILES |
C[C@H](N)C(=O)Nc1ccc(cc1)[N+]([O-])=O
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| InChI |
InChI=1S/C9H11N3O3/c1-6(10)9(13)11-7-2-4-8(5-3-7)12(14)15/h2-6H,10H2,1H3,(H,11,13)/t6-/m0/s1
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| InChIKey |
PXFUDSMGEYRNNC-LURJTMIESA-N
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| CAS |
1668-13-9
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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
Protein ID: PT04062, Solute carrier family 15 member 1
Protein ID: PT06345, Solute carrier family 15 member 2