SEQ2FUN

BioLiP

PDB CCD ID: NTB
Number of entries in BioLiP: 0
Chemical formula: C4 H11 N
InChI: InChI=1S/C4H11N/c1-4(2,3)5/h5H2,1-3H3
InChIKey: YBRBMKDOPFTVDT-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04NC(C)(C)C
CACTVS 3.341
OpenEye OEToolkits 1.5.0		CC(C)(C)N
Name:TERTIARY-BUTYLAMINE
ChEMBL: CHEMBL13782
ZINC: ZINC000004789979
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).