SEQ2FUN

BioLiP

PDB CCD ID:

Number of entries in BioLiP:

Chemical formula:

C16 H12 F N3 O2

InChI:

InChI=1S/C16H12FN3O2/c17-10-6-4-9(5-7-10)15(21)14-13(18)12(16(19)22)11-3-1-2-8-20(11)14/h1-8H,18H2,(H2,19,22)

InChIKey:

ORCDRDYWPJRKDA-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccn2c(c1)c(c(c2C(=O)c3ccc(cc3)F)N)C(=O)N
CACTVS 3.385	NC(=O)c1c(N)c(n2ccccc12)C(=O)c3ccc(F)cc3

Name:

2-azanyl-3-(4-fluorophenyl)carbonyl-indolizine-1-carboxamide

ChEMBL:

ZINC:

ZINC000004785358

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).