الاسم: N2,N4-bis(3-carboxyphenyl)-5-fluoro-2,4-pyrimidinediamine
SMILES:
O=C(O)c1cccc(Nc2ncc(F)c(Nc3cccc(C(=O)O)c3)n2)c1Molecular Processing
Molecular formula
C18H13FN4O4
Molecular weight
368.32
Exact mass
368.0921
XLogP
3.5
TPSA
124.44
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0
Molar refractivity
95.36
Supplementary Information
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