General Information of the Compound
| Compound ID |
CP0045202
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| Compound Name |
4-((S)-Amino-carboxy-methyl)-3-methyl-benzoic acid
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| Synonyms |
L-367385 analogs, Lilly
LY-367385
Metabotropic mGluR1 agonists, Lilly
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| Structure |
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| Formula |
C10H11NO4
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| Molecular Weight |
209.201
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| Canonical SMILES |
Cc1cc(ccc1[C@H](N)C(O)=O)C(O)=O
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| InChI |
InChI=1S/C10H11NO4/c1-5-4-6(9(12)13)2-3-7(5)8(11)10(14)15/h2-4,8H,11H2,1H3,(H,12,13)(H,14,15)/t8-/m0/s1
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| InChIKey |
SGIKDIUCJAUSRD-QMMMGPOBSA-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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Clinical Information about the Compound