BioLiP

PDB

BioLiP

PDB CCD ID:

TEE

Number of entries in BioLiP:

Chemical formula:

C2 H5 N S

InChI:

InChI=1S/C2H5NS/c3-1-2-4/h1-2,4H,3H2/b2-1-

InChIKey:

JLZMZFJVTNYDOT-UPHRSURJSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C(=CS)N
CACTVS 3.341	N\C=C/S
CACTVS 3.341	NC=CS
ACDLabs 10.04	S/C=C\N

Name:

2-AMINO-ETHENETHIOL;
2-THIOETHENAMINE

DrugBank:

DB01968

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).