Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LK47DU
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| Ligand Name |
(6S)-6-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(3R)-1-methylsulfonylpyrrolidin-3-yl]benzimidazol-2-yl]-1-(3-fluoranyl-4-methoxy-phenyl)piperidin-2-one
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| Synonyms |
(6S)-6-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(3R)-1-methylsulfonylpyrrolidin-3-yl]benzimidazol-2-yl]-1-(3-fluoranyl-4-methoxy-phenyl)piperidin-2-one; SCHEMBL20093938; JHF
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| Structure |
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Download2D MOL |
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| Formula |
C29H32FN5O5S
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| Canonical SMILES |
CC1=C(C(=NO1)C)C2=CC3=C(C=C2)N(C(=N3)C4CCCC(=O)N4C5=CC(=C(C=C5)OC)F)C6CCN(C6)S(=O)(=O)C
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| InChI |
1S/C29H32FN5O5S/c1-17-28(18(2)40-32-17)19-8-10-24-23(14-19)31-29(35(24)21-12-13-33(16-21)41(4,37)38)25-6-5-7-27(36)34(25)20-9-11-26(39-3)22(30)15-20/h8-11,14-15,21,25H,5-7,12-13,16H2,1-4H3/t21-,25+/m1/s1
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| InChIKey |
IXWWSEVQKVTANB-BWKNWUBXSA-N
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| PubChem Compound ID | ||||
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