Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L6CD2A
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| Ligand Name |
2-({4-[(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl]benzene-1-carbonyl}amino)-4-chlorobenzoic acid
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| Synonyms |
CHEMBL4591345; 2-({4-[(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl]benzene-1-carbonyl}amino)-4-chlorobenzoic acid; OE7; BDBM50528944
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| Structure |
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Download2D MOL |
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| Formula |
C21H16ClN5O4
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| Canonical SMILES |
C1=CC(=CC=C1CC2=CNC3=C2C(=O)NC(=N3)N)C(=O)NC4=C(C=CC(=C4)Cl)C(=O)O
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| InChI |
1S/C21H16ClN5O4/c22-13-5-6-14(20(30)31)15(8-13)25-18(28)11-3-1-10(2-4-11)7-12-9-24-17-16(12)19(29)27-21(23)26-17/h1-6,8-9H,7H2,(H,25,28)(H,30,31)(H4,23,24,26,27,29)
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| InChIKey |
OBHYLCXTIVOOGV-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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