Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LFN43A
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| Ligand Name |
Unk-D-hPhe-bAla(3S-Ph(4-CF3))-NHMe
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| Synonyms |
CHEMBL4746146; BDBM50563642; 3-methyl-5-(4-methyl-1,2,3-thiadiazol-5-yl)-N-((R)-1-(((R)-3-(methylamino)-3-oxo-1-(4-(trifluoromethyl)phenyl)propyl)amino)-1-oxo-4-phenylbutan-2-yl)isoxazole-4-carboxamide; S5E
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| Structure |
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Download2D MOL |
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| Formula |
C29H29F3N6O4S
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| Canonical SMILES |
CC1=C(SN=N1)C2=C(C(=NO2)C)C(=O)NC(CCC3=CC=CC=C3)C(=O)NC(CC(=O)NC)C4=CC=C(C=C4)C(F)(F)F
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| InChI |
1S/C29H29F3N6O4S/c1-16-24(25(42-37-16)26-17(2)36-38-43-26)28(41)34-21(14-9-18-7-5-4-6-8-18)27(40)35-22(15-23(39)33-3)19-10-12-20(13-11-19)29(30,31)32/h4-8,10-13,21-22H,9,14-15H2,1-3H3,(H,33,39)(H,34,41)(H,35,40)/t21-,22-/m1/s1
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| InChIKey |
RWENGGARDXLTTR-FGZHOGPDSA-N
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| PubChem Compound ID | ||||
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