Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L95QPR
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| Ligand Name |
3-[(1S)-1-[5-(2,2-dimethylmorpholin-4-yl)-2-[(4S)-2-(4-fluoro-3,5-dimethylphenyl)-3-[3-(4-fluoro-1-methylindazol-5-yl)-2-oxoimidazol-1-yl]-4-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carbonyl]indol-1-yl]butyl]-4H-1,2,4-oxadiazol-5-one
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| Structure |
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Download2D MOL
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| Formula |
C47H49F2N11O5
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| Canonical SMILES |
CCCC(C1=NOC(=O)N1)N2C3=C(C=C(C=C3)N4CCOC(C4)(C)C)C=C2C(=O)N5CCC6=NN(C(=C6C5C)N7C=CN(C7=O)C8=C(C9=C(C=C8)N(N=C9)C)F)C1=CC(=C(C(=C1)C)F)C
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| InChI |
1S/C47H49F2N11O5/c1-8-9-37(42-51-45(62)65-53-42)59-34-11-10-30(55-18-19-64-47(5,6)25-55)22-29(34)23-38(59)44(61)56-15-14-33-39(28(56)4)43(60(52-33)31-20-26(2)40(48)27(3)21-31)58-17-16-57(46(58)63)36-13-12-35-32(41(36)49)24-50-54(35)7/h10-13,16-17,20-24,28,37H,8-9,14-15,18-19,25H2,1-7H3,(H,51,53,62)/t28-,37-/m0/s1
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| InChIKey |
WUVYFHGOFAAJMK-AIJWEMPKSA-N
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| PubChem Compound ID | ||||
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