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MTC 智能计算中心MTC Computing Center AI × 蛋白质与酶工程AI for Protein & Enzyme Engineering

化合物信息

名称 内容
kegg编号 C07503
pubchemid 9706
name Tiagabine
formula C20H25NO2S2
structure
Isomeric_Smiles C1=CC=C(C(=C1)F)F
Cannoical_Smiles C1=CC=C(C(=C1)F)F
Gotenzyme_Smiles Cc1ccsc1C(=CCCN1CCC[C@@H](C(=O)O)C1)c1sccc1C