SMILES:
CON=C(C)c1ncc(F)c2c(C(=O)C(=O)N3CCN(c4nnnn4-c4ccccc4)CC3)c[nH]c12Molecular Processing
Molecular formula
C23H22FN9O3
Molecular weight
491.49
Exact mass
491.183
XLogP
1.58
TPSA
134.49
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
36
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.261
Molar refractivity
127.55
Supplementary Information
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