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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

BioLiP

PDB CCD ID: TZV
Number of entries in BioLiP: 2
Chemical formula: C16 H15 N3 O4 S
InChI: InChI=1S/C16H15N3O4S/c1-22-13-6-7-14-15(10-13)18-9-8-16(14)23-12-4-2-11(3-5-12)19-24(17,20)21/h2-10,19H,1H3,(H2,17,20,21)
InChIKey: YDPVHBWULHMYJX-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385COc1ccc2c(Oc3ccc(N[S](N)(=O)=O)cc3)ccnc2c1
ACDLabs 12.01c1cc(NS(=O)(=O)N)ccc1Oc3c2ccc(OC)cc2ncc3
OpenEye OEToolkits 2.0.7COc1ccc2c(ccnc2c1)Oc3ccc(cc3)NS(=O)(=O)N
Name:N-{4-[(7-methoxyquinolin-4-yl)oxy]phenyl}sulfuric diamide

Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).
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