| BioID | bio199927 |
|---|
| Name | None |
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| ChEMBL ID | CHEMBL46005 |
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| Molecular Formula | C11H16N2O9 |
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| Molecular Weight | 320.25 |
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| Molecular Weight (Monoisotopic) | 320.0856 |
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| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
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| Target Name | None |
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| Synonyms | (2S,2'S)-2,2'-Carbonylbis(Azanediyl)Dipentanedioic Acid |
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| Smiles | O=C(O)CC[C@H](NC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O |
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| Inchi | InChI=1S/C11H16N2O9/c14-7(15)3-1-5(9(18)19)12-11(22)13-6(10(20)21)2-4-8(16)17/h5-6H,1-4H2,(H,14,15)(H,16,17)(H,18,19)(H,20,21)(H2,12,13,22)/t5-,6-/m0/s1 |
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| Inchi Key | SOAPXKSPJAZNGO-WDSKDSINSA-N |
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| Molecular Species | ACID |
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| Targets | 4.0 |
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| Bioactivities | 9.0 |
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| Np Likeness Score | 0.04 |
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| Records Key | ['3', '(S)-Glu-C(O)-(S)-Glu', '10', '1, DUPA', '5'] |
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| Records Name | ['(S)-2-[3-((S)-3-Carboxy-1-carboxy-propyl)-ureido]-pentanedioic acid', '(S,S)-2-[3-(1,3-Dicarboxy-propyl)-ureido]-pentanedioic acid', (2S,2'S)-2,2'-carbonylbis(azanediyl)dipentanedioic acid", '(S,S)-2-[3-(1,3-dicarboxypropyl)ureido]pentanedioic acid', "(2S,2'S)-2,2'-carbonylbis(azanediyl)dipentanedioic acid"]" |
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| Withdrawn Flag | False |
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| Orphan | -1 |
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