Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L5WU8X
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| Ligand Name |
3-[[6-chloranyl-3-[3-[(1~{S})-1-(2,4-dichlorophenyl)ethyl]-5-phenyl-imidazol-4-yl]-1~{H}-indol-2-yl]carbonylamino]-4-[4-(2-oxidanylidene-1,3-oxazinan-3-yl)piperidin-1-yl]benzoic acid
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| Synonyms |
3-[[6-chloranyl-3-[3-[(1~{S})-1-(2,4-dichlorophenyl)ethyl]-5-phenyl-imidazol-4-yl]-1~{H}-indol-2-yl]carbonylamino]-4-[4-(2-oxidanylidene-1,3-oxazinan-3-yl)piperidin-1-yl]benzoic acid; SCHEMBL14335100; HRN
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| Structure |
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Download2D MOL
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| Formula |
C42H37Cl3N6O5
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| Canonical SMILES |
CC(C1=C(C=C(C=C1)Cl)Cl)N2C=NC(=C2C3=C(NC4=C3C=CC(=C4)Cl)C(=O)NC5=C(C=CC(=C5)C(=O)O)N6CCC(CC6)N7CCCOC7=O)C8=CC=CC=C8
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| InChI |
1S/C42H37Cl3N6O5/c1-24(30-11-9-27(43)21-32(30)45)51-23-46-37(25-6-3-2-4-7-25)39(51)36-31-12-10-28(44)22-33(31)47-38(36)40(52)48-34-20-26(41(53)54)8-13-35(34)49-17-14-29(15-18-49)50-16-5-19-56-42(50)55/h2-4,6-13,20-24,29,47H,5,14-19H2,1H3,(H,48,52)(H,53,54)/t24-/m0/s1
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| InChIKey |
GSVXCPWDMIREAJ-DEOSSOPVSA-N
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| PubChem Compound ID | ||||
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