Drug Information
| Drug General Information | |||||
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| Drug ID |
DX2UZC
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| Drug Name |
3-(3-{5-[2-tert-Butoxycarbonylamino-3-(1H-indol-3-yl)-propionylamino]-5-[1-(1-carbamoyl-2-phenyl-ethylcarbamoyl)-2-carboxy-ethylcarbamoyl]-pentyl}-ureido)-benzoic acid methyl ester
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| Synonyms |
CHEMBL3142905
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C44H54N8O11
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| Canonical SMILES |
COC(=O)c1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc4ccccc4)C(=O)N)c1
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| InChI |
InChI=1S/C44H54N8O11/c1-44(2,3)63-43(61)52-34(23-28-25-47-31-18-9-8-17-30(28)31)39(57)49-32(19-10-11-20-46-42(60)48-29-16-12-15-27(22-29)41(59)62-4)38(56)51-35(24-36(53)54)40(58)50-33(37(45)55)21-26-13-6-5-7-14-26/h5-9,12-18,22,25,32-35,47H,10-11,19-21,23-24H2,1-4H3,(H2,45,55)(H,49,57)(H,50,58)(H,51,56)(H,52,61)(H,53,54)(H2,46,48,60)/t32-,33-,34-,35-/m0/s1
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| InChIKey |
YJMMQRORYCUFDF-BBACVFHCSA-N
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| Target and Pathway | |||||
| Target(s) | Gastrin/cholecystokinin type B receptor | Target Info | [1587926] | ||
| Cholecystokinin receptor type A | Target Info | [1587926] | |||
| PANTHER Pathway | CCKR signaling map ST | ||||
| PathWhiz Pathway | Gastric Acid Production | ||||
| References | |||||
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