SMILES:
Cc1[nH]c(C=C2C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c32)c(C)c1CCC(=O)N1CCOCC1Molecular Processing
Molecular formula
C26H26ClFN6O3
Molecular weight
524.98
Exact mass
524.1739
XLogP
4.24
TPSA
112.24
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
37
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
139.21
Supplementary Information
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