SEQ2FUN

BioLiP

PDB CCD ID: MQN
Number of entries in BioLiP: 0
Chemical formula: C10 H10 N2
InChI: InChI=1S/C10H10N2/c1-7-2-3-8-6-9(11)4-5-10(8)12-7/h2-6H,11H2,1H3
InChIKey: TYJFYUVDUUACKX-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01n1c(ccc2cc(ccc12)N)C
OpenEye OEToolkits 1.7.6Cc1ccc2cc(ccc2n1)N
CACTVS 3.370Cc1ccc2cc(N)ccc2n1
Name:2-methylquinolin-6-amine
ChEMBL: CHEMBL1399676
ZINC: ZINC000000052868
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).