Open KlementineJBS opened 1 year ago
the smiles strings are corrupted @KlementineJBS is that a carborane?
the smiles strings are corrupted @KlementineJBS is that a carborane?
Yes! Sorry, the chemdraw file glitched out a bit.
Will add the SMILES back (and check they're not corrupted this time) later, sorry about that
Two researchers, @KlementineJBS and @animarfavi are in the process of synthesising the compounds below. We hope to have them completed by the end of 2023.
ChemDraw files
2023 Researcher targets for GitHub.zip
SMILES
CC1=C(NC2=NC(C3=CC=CC=N3)=CS2)N=CC=C1 CC1=NC(NC2=NC(C3=CC=CC=N3)=CS2)=CC=C1 O=N+=CC=C1)[O-] O=N+N=C1)[O-] O=N+=C1)[O-] [S]/C(NC(/N=C\C)=C)=N\CC1=CC=CC=N1 FC1=CC(NC2=NC(C3=CC=CC=N3)=CS2)=NC=C1 C1(C2=CSC(NC3=CC=CS3)=N2)=CC=CC=N1 C1(C2=CSC(NC3=CC=CO3)=N2)=CC=CC=N1 C1(C2=CSC(NC3(C[C@@H]4C5)CC@HC[C@H]5C3)=N2)=CC=CC=N1 F[C@]12CC@@HCC@@(C[C@@H]3C2)C1 F[C@]12CC@(F)CC(NC4=NC(C5=CC=CC=N5)=CS4)(C[C@]3(F)C2)C1 C1(C2=CSC(NC3=CC=CC=C3)=N2)=CC=CC=N1