Drug Information
| Drug General Information | |||||
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| Drug ID |
DX4VRI
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| Drug Name |
3-[2-[2-tert-Butoxycarbonylamino-3-(1H-indol-3-yl)-propionylamino]-5-(3-o-tolyl-ureido)-pentanoylamino]-N-(1-carbamoyl-2-phenyl-ethyl)-succinamic acid
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| Synonyms |
CHEMBL3142685
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C42H52N8O9
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| Canonical SMILES |
Cc1ccccc1NC(=O)NCCC[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
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| InChI |
InChI=1S/C42H52N8O9/c1-25-13-8-10-17-29(25)49-40(57)44-20-12-19-31(37(54)48-34(23-35(51)52)39(56)47-32(36(43)53)21-26-14-6-5-7-15-26)46-38(55)33(50-41(58)59-42(2,3)4)22-27-24-45-30-18-11-9-16-28(27)30/h5-11,13-18,24,31-34,45H,12,19-23H2,1-4H3,(H2,43,53)(H,46,55)(H,47,56)(H,48,54)(H,50,58)(H,51,52)(H2,44,49,57)/t31-,32-,33-,34-/m0/s1
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| InChIKey |
IPCYTZBCFJQCQL-CUPIEXAXSA-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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