LigandBoxID:D06217

NAME:Triampyzine sulfate
SMILES: CN(c1nc(c(nc1C)C)C)C

2D 3D

SDF file MOL2 file

Compound ID of the source

KEGG_DRUG
D06217

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C9H15N3 165.240 0 0
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
2 0 0.3329 -8.4348
LOGS LOGP    
$$$$ -2.0658    

Links to the same SMILES compounds

LIGANDBOX HTS1610-00283450
PUBCHEM 23484 23725058


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