LigandBoxID:PDB_NMG

NAME:NMG;GUANIDINO ACETATE;N-[AMINO(IMINO)METHYL]GLYCINE
SMILES: NC(NCC(=O)O)=N

2D 3D

SDF file MOL2 file

Compound ID of the source

PDB_LIGAND
NMG(PDBeCHEM) NMG(ChemComp)

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C3H6N3O2 116.100 -1 4
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
3 0 5.3541 -4.6903
LOGS LOGP    
-0.1634 -3.3589    

Links to the same SMILES compounds

LIGANDBOX C00581 HTS1610-00127986 KSH2016-01825555
CHEMBL CHEMBL281593
ZINC ZINC00895314


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