Name: EG00229
Rating: 5 (10 reviews)

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sdf 文件

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HIT ID:HIT212670690
Cas No:1210945-69-9
常用名:EG00229
IUPAC:(2S)-2-{[3-(2,1,3-benzothiadiazole-4-sulfonamido)thiophen-2-yl]formamido}-5-carbamimidamidopentanoic acid; trifluoroacetic acid
IUPAC:(2S)-2-{[3-(2,1,3-benzothiadiazole-4-sulfonamido)thiophen-2-yl]formamido}-5-carbamimidamidopentanoic acid; trifluoroacetic acid
InChI key:ZYQBITUOSRZDTG-MERQFXBCSA-N

分子式:C19H20F3N7O7S3
分子量:611.59
氢键供体数 (HBD):6
氢键受体数 (HBA):10
LogP:-0.76157653
SMILES:OC(=O)C(F)(F)F.NC(=N)NCCC[C@H](NC(=O)c1sccc1NS(=O)(=O)c1cccc2nsnc12)C(O)=O
SMILES:OC(=O)C(F)(F)F.NC(=N)NCCC[C@H](NC(=O)c1sccc1NS(=O)(=O)c1cccc2nsnc12)C(O)=O

EG00229 selectively inhibits VEGF-A binding to NRP1 b1 domain with an IC50 of 3 μM, but has no effect on VEGFA binding to VEGFR-1 and VEGFR-2. EG00229 is a neuropilin 1 (NRP1) receptor antagonist.

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