Compound Numbers,Molecule SMILES,Purity (%)
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1,[O-]C(=O)c1ccc(-c2ccnc3c2cc([nH]3)-c4c(OC)ccc(C[NH+](CC)CC)c4)cc1C(C)C,99.7
8a,[O-]C(=O)c1ccc(-c2ccnc3c2cc([nH]3)-c4c(OC)ccc(C[NH+](C)C)c4)cc1C(C)C,97.7
8b,[O-]C(=O)c1ccc(-c2ccnc3c2cc([nH]3)-c4c(OC)ccc(C[NH+]5CCCC5)c4)cc1C(C)C,100
8c,[O-]C(=O)c1ccc(-c2ccnc3c2cc([nH]3)-c4c(OC)ccc(C[NH+]5CCOCC5)c4)cc1C(C)C,95
9,CC(C)C1=CC(C2=C3C(NC(C4=C(OC)C=CC(CN(CC)CC)=C4)=C3)=NC=C2)=CC=C1C(OCC)=O,100
12,[O-]C(=O)c1ccc(-c2ccnc3c2cc([nH]3)-c4cc(C[NH3+])ccc4OC)cc1C(C)C,100
15,[O-]C(=O)c1ccc(-c2ccnc3c2cc([nH]3)-c4ccccc4OC)cc1C(C)C,100
19,Oc1ccc(C[NH+](CC)CC)cc1-c2cc3c([nH]2)nccc3-c4ccc(c(C(C)C)c4)C([O-])=O,98.4
23,[O-]C(=O)c1ccc(-c2ccnc3c2cc([nH]3)-c4cccc(C[NH+](CC)CC)c4)cc1C(C)C,100
27,CC(C)C1=CC(C2=C3C(NC(C4=CC=CC(CN(CC)CC)=C4OC)=C3)=NC=C2)=CC=C1C(O)=O,100
28,CC1=CC(C2=C3C(NC(C4=C(OC)C=CC(CN(CC)CC)=C4)=C3)=NC=C2)=CC=C1C(O)=O,100
29,CCN(CC)CC1=CC(C2=CC3=C(C4=CC=C(C(O)=O)C=C4)C=CN=C3N2)=C(OC)C=C1,97.9
30,CC(C)C1=CC(C2=C3C(NC(C4=C(OC)C=CC(CN(CC)CC)=C4)=C3)=NC=C2)=CC=C1C5=NN=NN5,100
31,CC(C)C1=CC(C2=C3C(NC(C4=C(OC)C=CC(CN(CC)CC)=C4)=C3)=NC=C2)=CC=C1,98.9
32,CC(C)C(C(C(O)=O)=C1)=CC=C1C2=C3C(NC(C4=C(OC)C=CC(CN(CC)CC)=C4)=C3)=NC=C2,100