LigandBoxID:D00815

NAME:Imipramine hydrochloride;Tofranil
SMILES: CN(CCCN3c1ccccc1CCc2ccccc32)C

2D 3D

SDF file MOL2 file

Compound ID of the source

KEGG_DRUG
D00815

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C19H25N2 281.423 1 1
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
0 0 -3.9820 -11.2856
LOGS LOGP    
-4.4248 4.8099    

Links to the same SMILES compounds

LIGANDBOX C07049 C07982 D08070 HTS1610-00159393 HTS1610-00159394
KSH2016-03829483 PDB_IXX
CHEMBL CHEMBL11 CHEMBL1692
ZINC ZINC00020245
PUBCHEM 11535149 115863 11620620 12291959 15893898
20563165 25167417 25167421 3434472 3696 45039559
45039560 451081 45358997 56841367 657207 8228
9873569 9957285


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