SEQ2FUN

BioLiP

PDB CCD ID: G4O
Number of entries in BioLiP: 0
Chemical formula: C3 H9 N
InChI: InChI=1S/C3H9N/c1-3(2)4/h3H,4H2,1-2H3
InChIKey: JJWLVOIRVHMVIS-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385
OpenEye OEToolkits 2.0.7		CC(C)N
Name:propan-2-amine
ChEMBL: CHEMBL117080
ZINC: ZINC000008220693
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).