이름: ethyl 3-((3-((5-fluoro-2-((4-(2-methoxyethoxy)phenyl)amino)pyrimidin-4-yl)amino)phenyl)amino)-3-oxopropanoate
SMILES:
CCOC(=O)CC(=O)Nc1cccc(Nc2nc(Nc3ccc(OCCOC)cc3)ncc2F)c1Molecular Processing
Molecular formula
C24H26FN5O5
Molecular weight
483.5
Exact mass
483.1918
XLogP
4.02
TPSA
123.7
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
12
Heavy atoms
35
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
128.69
Supplementary Information
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