Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L6I0PK
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| Ligand Name |
(R)-3-(4-Bromobenzylthio)-2-(3-(3-((2,4-Difluorophenyl)ethynyl)benzoyl)-3-Propylureido)propanoic Acid
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| Synonyms |
CHEMBL3125476; (R)-3-(4-Bromobenzylthio)-2-(3-(3-((2,4-Difluorophenyl)ethynyl)benzoyl)-3-Propylureido)propanoic Acid; 4c5d; BDBM50066762; Q27467395; (R)-2-[3-Propyl-3-[3-[(2,4-difluorophenyl)ethynyl]benzoyl]ureido]-3-[(4-bromobenzyl)thio]propanoic acid; X0R
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| Structure |
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Download2D MOL |
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| Formula |
C29H25BrF2N2O4S
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| Canonical SMILES |
CCCN(C(=O)C1=CC=CC(=C1)C#CC2=C(C=C(C=C2)F)F)C(=O)NC(CSCC3=CC=C(C=C3)Br)C(=O)O
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| InChI |
1S/C29H25BrF2N2O4S/c1-2-14-34(29(38)33-26(28(36)37)18-39-17-20-7-11-23(30)12-8-20)27(35)22-5-3-4-19(15-22)6-9-21-10-13-24(31)16-25(21)32/h3-5,7-8,10-13,15-16,26H,2,14,17-18H2,1H3,(H,33,38)(H,36,37)/t26-/m0/s1
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| InChIKey |
WDPWVHPOPPOGPB-SANMLTNESA-N
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| PubChem Compound ID | ||||
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