Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LAXS35
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| Ligand Name |
2-Fluoro-5-{5-[(2e,4ar,7ar)-2-Imino-3-Methyl-4-Oxo-6-Phenyloctahydro-7ah-Pyrrolo[3,4-D]pyrimidin-7a-Yl]thiophen-2-Yl}benzonitrile
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| Synonyms |
CHEMBL2178148; 2-Fluoro-5-{5-[(2e,4ar,7ar)-2-Imino-3-Methyl-4-Oxo-6-Phenyloctahydro-7ah-Pyrrolo[3,4-D]pyrimidin-7a-Yl]thiophen-2-Yl}benzonitrile; BDBM50398681; Q27451598; 10W
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| Structure |
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Download2D MOL |
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| Formula |
C24H20FN5OS
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| Canonical SMILES |
CN1C(=O)C2CN(CC2(N=C1N)C3=CC=C(S3)C4=CC(=C(C=C4)F)C#N)C5=CC=CC=C5
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| InChI |
1S/C24H20FN5OS/c1-29-22(31)18-13-30(17-5-3-2-4-6-17)14-24(18,28-23(29)27)21-10-9-20(32-21)15-7-8-19(25)16(11-15)12-26/h2-11,18H,13-14H2,1H3,(H2,27,28)/t18-,24-/m0/s1
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| InChIKey |
DWVJKKOFIHHAKC-UUOWRZLLSA-N
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| PubChem Compound ID | ||||
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