Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LC04TP
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Ligand Name |
3-[5-(3-Cyclohexyl-3,5,8,10-tetrazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),4,7,11-pentaen-4-yl)furan-2-yl]propanenitrile
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Synonyms |
CHEMBL4127590; 3-[5-(3-cyclohexyl-3,5,8,10-tetrazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),4,7,11-pentaen-4-yl)furan-2-yl]propanenitrile; BDBM50274601; F48
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Structure |
Download2D MOL |
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Formula |
C21H21N5O
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Canonical SMILES |
C1CCC(CC1)N2C3=C4C=CNC4=NC=C3N=C2C5=CC=C(O5)CCC#N
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InChI |
1S/C21H21N5O/c22-11-4-7-15-8-9-18(27-15)21-25-17-13-24-20-16(10-12-23-20)19(17)26(21)14-5-2-1-3-6-14/h8-10,12-14H,1-7H2,(H,23,24)
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InChIKey |
PLKGAHIHTTYWEV-UHFFFAOYSA-N
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PubChem Compound ID |
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