Gly-Gly-Gly-PEG4-DBCO
HIT212667759
sdf文件结构编辑类似物检索
HIT ID: HIT212667759
Cas No: 2353409-80-8
分子式: C35H46N6O9
分子量: 694.786
常用名: Gly-Gly-Gly-PEG4-DBCO
氢键受体数 (HBA): 10
氢键供体数 (HBD): 5
LogP: -2.1118205
IUPAC: N-(14-{2-[2-(2-aminoacetamido)acetamido]acetamido}-3,6,9,12-tetraoxatetradecan-1-yl)-4-{2-azatricyclo[10.4.0.0^{4,9}]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl}-4-oxobutanamide
IUPAC: N-(14-{2-[2-(2-aminoacetamido)acetamido]acetamido}-3,6,9,12-tetraoxatetradecan-1-yl)-4-{2-azatricyclo[10.4.0.0^{4,9}]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl}-4-oxobutanamide
SMILES: NCC(=O)NCC(=O)NCC(=O)NCCOCCOCCOCCOCCNC(=O)CCC(=O)N1Cc2ccccc2C#Cc2ccccc12
SMILES: NCC(=O)NCC(=O)NCC(=O)NCCOCCOCCOCCOCCNC(=O)CCC(=O)N1Cc2ccccc2C#Cc2ccccc12
InChI key: IQIPCHLKYRUJEB-UHFFFAOYSA-N
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