General Information of the Compound
| Compound ID |
CP0390064
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| Compound Name |
(1S,2S,4S,5R,6S)-2-amino-4-[(2-cyclohexylacetyl)amino]bicyclo[3.1.0]hexane-2,6-dicarboxylic acid
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| Structure |
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| Formula |
C16H24N2O5
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| Molecular Weight |
324.377
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| Canonical SMILES |
N[C@]1(C[C@H](NC(=O)CC2CCCCC2)[C@H]2[C@@H]([C@@H]12)C(O)=O)C(O)=O
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| InChI |
InChI=1S/C16H24N2O5/c17-16(15(22)23)7-9(11-12(13(11)16)14(20)21)18-10(19)6-8-4-2-1-3-5-8/h8-9,11-13H,1-7,17H2,(H,18,19)(H,20,21)(H,22,23)/t9-,11-,12-,13-,16-/m0/s1
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| InChIKey |
AQCRJOWGCAFEAA-CTIKTKRKSA-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: PT01748, Metabotropic glutamate receptor 2
Protein ID: PT01312, Metabotropic glutamate receptor 3