LigandBoxID:D04375

NAME:Guanabenz
SMILES: NC(NN=Cc1c(cccc1[Cl])[Cl])=N

2D 3D

SDF file MOL2 file

Compound ID of the source

KEGG_DRUG
D04375

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C8H8N4Cl2 231.086 0 4
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
2 0 -0.7400 -8.8610
LOGS LOGP    
-3.4528 2.9218    

Links to the same SMILES compounds

LIGANDBOX C07034 D00605 HTS1610-00122472 HTS1610-00122473
CHEMBL CHEMBL1200560 CHEMBL1313657 CHEMBL1331786 CHEMBL1527653 CHEMBL1876448
ZINC ZINC00001522 ZINC04685861


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