Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LLP20S
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Ligand Name |
Aziridine form
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Synonyms |
aziridine form; KRAS(G12C) inhibitor
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Structure |
Download2D MOL |
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Formula |
C23H23ClFN7O
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Canonical SMILES |
CC1=C(C2=C(C=C1)NN=C2)C3=C(C=C4C(=C3F)N=CN=C4N5CCN(CC5)C(=O)CCN)Cl
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InChI |
1S/C23H23ClFN7O/c1-13-2-3-17-15(11-29-30-17)19(13)20-16(24)10-14-22(21(20)25)27-12-28-23(14)32-8-6-31(7-9-32)18(33)4-5-26/h2-3,10-12H,4-9,26H2,1H3,(H,29,30)
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InChIKey |
VJDYKBMYNVLSKK-UHFFFAOYSA-N
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PubChem Compound ID |
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