SEQ2FUN

BioLiP

PDB CCD ID: TSR
Number of entries in BioLiP: 8
Chemical formula: C10 H10 N2 O
InChI: InChI=1S/C10H10N2O/c11-10(13)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,12H,5H2,(H2,11,13)
InChIKey: ZOAMBXDOGPRZLP-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1ccc2c(c1)c(c[nH]2)CC(=O)N
CACTVS 3.341NC(=O)Cc1c[nH]c2ccccc12
ACDLabs 10.04O=C(N)Cc2c1ccccc1nc2
Name:2-(1H-INDOL-3-YL)ACETAMIDE
DrugBank: DB08652
ZINC: ZINC000000409269
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).