Name: Brilacidin
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT212708350
Cas No:1224095-98-0
常用名:Brilacidin
别名:PMX 30063
IUPAC:N4,N6-bis[3-(5-carbamimidamidopentanamido)-2-[(3R)-pyrrolidin-3-yloxy]-5-(trifluoromethyl)phenyl]pyrimidine-4,6-dicarboxamide
IUPAC:N4,N6-bis[3-(5-carbamimidamidopentanamido)-2-[(3R)-pyrrolidin-3-yloxy]-5-(trifluoromethyl)phenyl]pyrimidine-4,6-dicarboxamide
InChI key:QPDYBCZNGUJZDK-DNQXCXABSA-N

分子式:C40H50F6N14O6
分子量:936.922
氢键供体数 (HBD):12
氢键受体数 (HBA):16
LogP:0.01767056
SMILES:NC(=N)NCCCCC(=O)Nc1cc(cc(NC(=O)c2cc(ncn2)C(=O)Nc2cc(cc(NC(=O)CCCCNC(N)=N)c2O[C@@H]2CCNC2)C(F)(F)F)c1O[C@@H]1CCNC1)C(F)(F)F
SMILES:NC(=N)NCCCCC(=O)Nc1cc(cc(NC(=O)c2cc(ncn2)C(=O)Nc2cc(cc(NC(=O)CCCCNC(N)=N)c2O[C@@H]2CCNC2)C(F)(F)F)c1O[C@@H]1CCNC1)C(F)(F)F

Brilacidin is a nonpeptidic anti-infective in a new class of defensin mimetics used for the research of eye infections.

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