LigandBoxID:D02234

NAME:Cyproheptadine hydrochloride;Periactin
SMILES: CN1CCC(=C4c2ccccc2C=Cc3ccccc43)CC1

2D 3D

SDF file MOL2 file

Compound ID of the source

KEGG_DRUG
D02234

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C21H22N 288.414 1 1
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
0 0 -3.7429 -11.1356
LOGS LOGP    
-10.7811 6.9421    

Links to the same SMILES compounds

LIGANDBOX C06935 D07765 HTS1610-00000498 HTS1610-02682910 KSH2016-00015898
KSH2016-00060538
CHEMBL CHEMBL1716 CHEMBL516
ZINC ZINC00968264
PUBCHEM 11954233 13770 2913 4141783 43834424
44299947 45157477 481767 6441505 657241


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