Drug Information
| Drug General Information | |||||
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| Drug ID |
DX3WWS
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| Drug Name |
3-{6-(3-Benzyl-ureido)-2-[2-tert-butoxycarbonylamino-3-(1H-indol-3-yl)-propionylamino]-hexanoylamino}-N-(1-carbamoyl-2-phenyl-ethyl)-succinamic acid
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| Synonyms |
CHEMBL3142687
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C43H54N8O9
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| Canonical SMILES |
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)NCc3ccccc3)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc4ccccc4)C(=O)N
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| InChI |
InChI=1S/C43H54N8O9/c1-43(2,3)60-42(59)51-34(23-29-26-46-31-19-11-10-18-30(29)31)39(56)48-32(20-12-13-21-45-41(58)47-25-28-16-8-5-9-17-28)38(55)50-35(24-36(52)53)40(57)49-33(37(44)54)22-27-14-6-4-7-15-27/h4-11,14-19,26,32-35,46H,12-13,20-25H2,1-3H3,(H2,44,54)(H,48,56)(H,49,57)(H,50,55)(H,51,59)(H,52,53)(H2,45,47,58)/t32-,33-,34-,35-/m0/s1
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| InChIKey |
UIDOTSRLRNFLFJ-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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