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Molecule ID: FYI-1001613 Edit
Molecule Structure SMILES String:
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Molecule Summary: ID: FYI-1002051 Names: InChIKey: GACQNUHFDBEIQH-HNNXBMFYS A-NSMILES: Cc5ccc(c2ccc1...
Molecule Summary: ID: FYI-1002474 Names: InChIKey: BRXSUDPDZCGKBW-UHFFFAOYS A-NSMILES: O=C(c1ccccc1)...
What happens if a ring is in the molecule FP2 fragment path? In the Open Babel FP2 fingerprint algor...
Molecule Summary: ID: FYI-1000951 SMILES: CCCCCC1=CC(=C(C(=C1)O)C2 C=C(CCC2C(=C)C)C)OReceived at FYI...
Molecule Summary: ID: FYI-1000938 SMILES: O=S(NC(NC1=C(CCC2)C2=CC= C1C3=CC=NC(OC)=C3)=O)(N( C4=CN(C)N=...