BioLiP

PDB

BioLiP

PDB CCD ID:

EWF

Number of entries in BioLiP:

Chemical formula:

C8 H10 N2 O2 S

InChI:

InChI=1S/C8H10N2O2S/c9-13(11,12)10-6-5-7-3-1-2-4-8(7)10/h1-4H,5-6H2,(H2,9,11,12)

InChIKey:

IWPJHISUYDXHGJ-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccc2c(c1)CCN2S(=O)(=O)N
CACTVS 3.385	N[S](=O)(=O)N1CCc2ccccc12

Name:

2,3-dihydroindole-1-sulfonamide;
indoline-1-sulfonamide

ZINC:

ZINC000036924388

Reference:

Chengxin Zhang, Xi Zhang, Lydia 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).