diABZI STING agonist-1 (Tautomerism)

Sunan Sinadari:

(E) -1-((E) -4-((E) -5-carbamoyl-2-((1-ethyl-3-methyl-1H-pyrazole-5-carbonyl) imino) -7- (3-) morpholinopropoxy -2,3-dihydro-1H-benzo [d] imidazole-1-yl) amma-2-en-1-yl)-2-(1-ethyl-3-methyl-1H-pyrazole-5- carbonyl) imino) -7-methoxy-2,3-dihydro-1H-benzo [d] imidazole-5-carboxamide

Lambar SMILES:

O=C(N)C1=CC(N/C(N2C/C=C/CN3/C(NC4=C3C(OCCCN5CCOCC5)=CC(C(N)=O)=C4)=N/C(C6= CC(C)=NN6CC)=O)=NC(C7=CC(C)=NN7CC)=O=C2C(OC)=C1

Lambar InChi:

InChi=1S/C42H51N13O7/c1-6-54-31(19-25(3)49-54)39(58)47-41-45-29-21-27(37(43)56)23-33( 60-5) 35 (29) 52 (41) 12-8-9-13-53-36-30 (46-42 (53) 48-40 (59) 32-20-26 (4) 50-55 32)7-2)22-28 (38 (44)57)24-34 (36)62-16-10-11-51-14-17-61-18-15-51/h8-9,19- 24H,6-7,10-18H2,1-5H3,(H2,43,56)(H2,44,57)(H,45,47,58)(H,46,48,59)/b9-8 +

InChi Key:

JGLMVXWAHNTPRF-CMDGGOBGSA-N

Mabuɗin kalma:

Solubility: 

Ajiya: 

Bayani:

diABZI STING agonist-1 Tautomerism (compound 3) wani zaɓi ne mai zaɓaɓɓen agonist mai karɓa na ƙwayoyin cuta na interferon (STING), tare da EC50s na 130, 186 nM don ɗan adam da linzamin kwamfuta, bi da bi.

Manufar: STING