LigandBoxID:D00329

NAME:Flurazepam;Insumin
SMILES: CCN(CCN2C(CN=C(c3cc(ccc32)[Cl])c1ccccc1F)=O)CC

2D 3D

SDF file MOL2 file

Compound ID of the source

KEGG_DRUG
D00329

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C21H24N3OFCl 388.894 1 1
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
2 0 -4.1150 -11.8500
LOGS LOGP    
-5.0636 4.0050    

Links to the same SMILES compounds

LIGANDBOX D00695 D01408 PDB_FL7
CHEMBL CHEMBL1200602 CHEMBL968
ZINC ZINC00537752
PUBCHEM 14434 25273208 3393 37368


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