LigandBoxID:PDB_CFZ

NAME:CFZ
SMILES: NC=1C=CN(C2OC(C(C2F)O)COP(=O)(O)O)C(N=1)=O

2D 3D

select 3D conformers:
SDF file MOL2 file

Compound ID of the source

PDB_LIGAND
CFZ(PDBeCHEM) CFZ(ChemComp)

Calculated physical properties

MOLECULAR_FORMULA MOLECULAR_WEIGHT MOLECULAR_CHARGE NUM_OF_DONOR
C9H11N3O7FP 323.173 -2 3
NUM_OF_ACCEPTOR NUM_OF_CHIRAL_ATOMS LUMO HOMO
8 4 3.3653 0.6686
LOGS LOGP    
$$$$ -0.4321    

Links to the same SMILES compounds

LIGANDBOX PDB_CFL
PUBCHEM 49866782


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