LigandBoxID:D03461

NAME:Chloramphenicol pantothenate complex;Pantofenicol
SMILES: OCC(C(c1ccc(cc1)N(=O)O)O)NC(C([Cl])[Cl])=O

2D 3D

select 3D conformers:
SDF file MOL2 file

Compound ID of the source

KEGG_DRUG
D03461

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C11H12N2O5Cl2 323.132 0 3
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
5 2 -1.9136 -10.9074
LOGS LOGP    
$$$$ $$$$    

Links to the same SMILES compounds

LIGANDBOX C00918 D00104 HTS1610-00138518 HTS1610-00138519 HTS1610-00142242
HTS1610-00142243 HTS1610-00148893 HTS1610-00148894 KSH2016-00058303 KSH2016-01633394 PDB_CLM
PDB_LCL
CHEMBL CHEMBL130 CHEMBL1437336 CHEMBL414400
ZINC ZINC00113378 ZINC00113382 ZINC00113386 ZINC00113389
PUBCHEM 11301788 11954346 13094456 13094457 146033
146034 16399516 20056850 21115961 21115971 21115972
21115973 21115974 21150919 21153961 21857773 23615637
23617344 23724871 298 3081163 35774 44145333
44145883 44147146 44147727 44148049 44149055 44152157
44153307 44153907 44177731 45038608 54670174 5959
60098667 92099 9916754


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