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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 C07259
pubchemid 9468
name Sildenafil
formula C22H30N6O4S
structure
Isomeric_Smiles CCCN(CCC)CCOC(=O)C1=CC=C(C=C1)F
Cannoical_Smiles CCCN(CCC)CCOC(=O)C1=CC=C(C=C1)F
Gotenzyme_Smiles CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)nc12