SEQ2FUN

BioLiP

PDB CCD ID: 547
Number of entries in BioLiP: 1
Chemical formula: C25 H26 N4 O
InChI: InChI=1S/C25H26N4O/c1-3-7-19(8-4-1)22-23-21(27-15-18-29-16-13-26-14-17-29)11-12-28-25(23)30-24(22)20-9-5-2-6-10-20/h1-12,26H,13-18H2,(H,27,28)
InChIKey: QUIQCYFSBGOBKE-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04n1ccc(c2c1oc(c2c3ccccc3)c4ccccc4)NCCN5CCNCC5
CACTVS 3.341C1CN(CCN1)CCNc2ccnc3oc(c4ccccc4)c(c5ccccc5)c23
OpenEye OEToolkits 1.5.0c1ccc(cc1)c2c3c(ccnc3oc2c4ccccc4)NCCN5CCNCC5
Name:2,3-DIPHENYL-N-(2-PIPERAZIN-1-YLETHYL)FURO[2,3-B]PYRIDIN-4-AMINE;
FURANOPYRIDINE 8
ChEMBL: CHEMBL392990
DrugBank: DB07146
ZINC: ZINC000023359504
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).