LigandBoxID:PDB_OSE

NAME:OSE;O-SULFO-L-SERINE
SMILES: OC(C(COS(=O)(=O)O)N)=O

2D 3D

select 3D conformers:
SDF file MOL2 file

Compound ID of the source

PDB_LIGAND
OSE(PDBeCHEM) OSE(ChemComp)

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C3H6NO6S 184.147 -1 3
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
6 1 2.1036 -6.2514
LOGS LOGP    
0.6326 -4.6104    

Links to the same SMILES compounds

LIGANDBOX C02703
CHEMBL CHEMBL28885
ZINC ZINC04095907 ZINC04899846
PUBCHEM 10081123 10241524 10261827 10330057 10375281
10420063 10465061 164701 23702149 25239977 25240575
25240581 25241112 4371770 44277954 7098632 7408680
7408681 9989996


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