Drug Information
| Drug General Information | |||||
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| Drug ID |
DX3ECJ
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| Drug Name |
3-{2-[2-tert-Butoxycarbonylamino-3-(1H-indol-3-yl)-propionylamino]-6-[3-(2,4-dichloro-phenyl)-acryloylamino]-hexanoylamino}-N-(1-carbamoyl-2-phenyl-ethyl)-succinamic acid; hydrate
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| Synonyms |
CHEMBL3144549
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C44H51Cl2N7O9
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| Canonical SMILES |
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)\\C=C/c3ccc(Cl)cc3Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc4ccccc4)C(=O)N
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| InChI |
InChI=1S/C44H51Cl2N7O9/c1-44(2,3)62-43(61)53-35(22-28-25-49-32-14-8-7-13-30(28)32)41(59)50-33(15-9-10-20-48-37(54)19-17-27-16-18-29(45)23-31(27)46)40(58)52-36(24-38(55)56)42(60)51-34(39(47)57)21-26-11-5-4-6-12-26/h4-8,11-14,16-19,23,25,33-36,49H,9-10,15,20-22,24H2,1-3H3,(H2,47,57)(H,48,54)(H,50,59)(H,51,60)(H,52,58)(H,53,61)(H,55,56)/b19-17-/t33-,34-,35-,36-/m0/s1
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| InChIKey |
MAOQKQHUYPZBNR-ZMQUUFOHSA-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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