General Information of the Compound
| Compound ID |
CP0538836
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| Compound Name |
(2S)-2-amino-4-[hydroxy-[(3-nitrophenyl)-(2-phenylethylamino)methyl]phosphoryl]butanoic acid
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| Structure |
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| Formula |
C19H24N3O6P
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| Molecular Weight |
421.39
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| Canonical SMILES |
N[C@@H](CCP(O)(=O)C(NCCc1ccccc1)c1cccc(c1)[N+]([O-])=O)C(O)=O
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| InChI |
InChI=1S/C19H24N3O6P/c20-17(19(23)24)10-12-29(27,28)18(15-7-4-8-16(13-15)22(25)26)21-11-9-14-5-2-1-3-6-14/h1-8,13,17-18,21H,9-12,20H2,(H,23,24)(H,27,28)/t17-,18?/m0/s1
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| InChIKey |
MRMZJDLBFJOMCZ-ZENAZSQFSA-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
Protein ID: PT02199, Metabotropic glutamate receptor 4
Protein ID: PT02739, Metabotropic glutamate receptor 8