LigandBoxID:PDB_CF0

NAME:CF0;fluoromethane;Fluoro methyl group
SMILES: FC

2D 3D

SDF file MOL2 file

Compound ID of the source

PDB_LIGAND
CF0(PDBeCHEM) CF0(ChemComp)

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
CH3F 34.033 0 0
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
0 0 3.9551 -12.1608
LOGS LOGP    
-0.1351 0.6975    

Links to the same SMILES compounds

LIGANDBOX C11147
CHEMBL CHEMBL116838
PUBCHEM 11638 12336970 13351298 13351311 136358
138041 18430331 18534502 186213 18624881 19389419
19609546 20604868 20604871 20755981 20795489 22218664
22272224 22954018 23551995 450707 450725 54412168
54412169 54521833 57464774 57465076 57494351 57503123
57504157 57772434 58028062 58078352 58118975 58251117
58276195 58338844 58747252 58755848 59048127 59428875
59428876 59889578 59906177 59907226 59946627 59958636
60086371 9833918


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