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FURNA

PDB CCD ID: DX4
Number of entries in FURNA: 4
Chemical formula: C5 H5 N5 S
InChI: InChI=1S/C5H5N5S/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11)
InChIKey: WYWHKKSPHMUBEB-UHFFFAOYSA-N
SMILES: S=C1c2ncnc2N=C(N1)N;
NC1=Nc2[nH]cnc2C(=S)N1;
c1[nH]c2c(n1)C(=S)NC(=N2)N
Name:2-amino-1,9-dihydro-6H-purine-6-thione
ChEMBL: CHEMBL727
DrugBank: DB00352
ZINC: ZINC000006382803

Reference:
  • Chengxin Zhang, P. Lydia Freddolino (2023) FURNA: a database for function annotations of RNA structures, bioRxiv 2023.12.19.572314.
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