Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LA69RD
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Ligand Name |
(5s,7s)-N~3~-methyl-10-[3-methyl-3-(5-methyl-1,3-oxazol-2-yl)but-1-yn-1-yl]-6,7-dihydro-5H-5,7-methanoimidazo[2,1-a][2]benzazepine-2,3-dicarboxamide
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Synonyms |
CHEMBL4444206; (5s,7s)-N~3~-methyl-10-[3-methyl-3-(5-methyl-1,3-oxazol-2-yl)but-1-yn-1-yl]-6,7-dihydro-5H-5,7-methanoimidazo[2,1-a][2]benzazepine-2,3-dicarboxamide; BDBM50502745; 9X4
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Structure |
Download2D MOL |
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Formula |
C25H25N5O3
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Canonical SMILES |
CC1=CN=C(O1)C(C)(C)C#CC2=CC3=C(C=C2)C4CC(C4)N5C3=NC(=C5C(=O)NC)C(=O)N
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InChI |
1S/C25H25N5O3/c1-13-12-28-24(33-13)25(2,3)8-7-14-5-6-17-15-10-16(11-15)30-20(23(32)27-4)19(21(26)31)29-22(30)18(17)9-14/h5-6,9,12,15-16H,10-11H2,1-4H3,(H2,26,31)(H,27,32)
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InChIKey |
BVQAJAHFWBYNPF-UHFFFAOYSA-N
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PubChem Compound ID |
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