0  B31R3.4078999394  CCC(CC)(CC(=O)NC1=CC(=CC=C1)C=CC2=NC(=CS2)C3CCC3)C(=O)O MCULE-3687798795 [0,0,0,0,0,0|0,0,0]=0
1  B31R3.4078999394  CCC(CC)(CC(=O)NC1=CC=CC(=C1)/C=C/C2=NC(=CS2)C3CCC3)C(=O)O MCULE-1139122159 [0,0,0,0,0,0|0,0,0]=0
2  B29R2.616702129  CCC(CC)(CC(=O)NC1=CC=CC(=C1)C=CC2=NC(=CS2)C(C)C)C(=O)O MCULE-6161688441 [1,0,1,0,0,0|0,0,0]=2