Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
L6POH0
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Ligand Name |
Ac-Ala-thionoHyp-Unk
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Synonyms |
CHEMBL4225198; BDBM50461568; DV2
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Structure |
Download2D MOL |
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Formula |
C21H26N4O3S2
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Canonical SMILES |
CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=S)C3CC(CN3C(=O)C(C)NC(=O)C)O
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InChI |
1S/C21H26N4O3S2/c1-12-19(30-11-23-12)16-6-4-15(5-7-16)9-22-20(29)18-8-17(27)10-25(18)21(28)13(2)24-14(3)26/h4-7,11,13,17-18,27H,8-10H2,1-3H3,(H,22,29)(H,24,26)/t13-,17+,18-/m0/s1
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InChIKey |
XGBXEQHIGHVMKO-VHSSKADRSA-N
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PubChem Compound ID |
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