Name: STING agonist-19
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT217583352
Cas No:2886007-54-9
常用名:STING agonist-19
IUPAC:1-[(2E)-4-[5-carbamoyl-2-(1-ethyl-3-methyl-1H-pyrazole-5-amido)-1H-1,3-benzodiazol-1-yl]but-2-en-1-yl]-2-(1-ethyl-3-methyl-1H-pyrazole-5-amido)-7-[3-(piperazin-1-yl)propoxy]-1H-1,3-benzodiazole-5-carboxamide
IUPAC:1-[(2E)-4-[5-carbamoyl-2-(1-ethyl-3-methyl-1H-pyrazole-5-amido)-1H-1,3-benzodiazol-1-yl]but-2-en-1-yl]-2-(1-ethyl-3-methyl-1H-pyrazole-5-amido)-7-[3-(piperazin-1-yl)propoxy]-1H-1,3-benzodiazole-5-carboxamide
InChI key:URPMHTRSFGUHTO-BQYQJAHWSA-N

分子式:C41H50N14O5
分子量:818.944
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCn1nc(C)cc1C(=O)Nc1nc2cc(ccc2n1C\C=C\Cn1c(NC(=O)c2cc(C)nn2CC)nc2cc(cc(OCCCN3CCNCC3)c12)C(N)=O)C(N)=O
SMILES:CCn1nc(C)cc1C(=O)Nc1nc2cc(ccc2n1C\C=C\Cn1c(NC(=O)c2cc(C)nn2CC)nc2cc(cc(OCCCN3CCNCC3)c12)C(N)=O)C(N)=O

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