LigandBoxID:D01328

NAME:Clotiazepam;Rize
SMILES: CCc1cc3C(c2ccccc2[Cl])=NCC(N(c3s1)C)=O

2D 3D

SDF file MOL2 file

Compound ID of the source

KEGG_DRUG
D01328

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C16H15N2OSCl 318.827 0 0
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
2 0 -0.7123 -9.1508
LOGS LOGP    
-5.4731 3.5239    

Links to the same SMILES compounds

CHEMBL CHEMBL1697737
PUBCHEM 2811


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