Cc1ccc(-c2c(N)ncnc2N2CCC(c3nc(-c4ccc(F)c(C(F)(F)F)c4)cn3C)CC2)s1
SMILES: Cc1ccc(-c2c(N)ncnc2N2CCC(c3nc(-c4ccc(F)c(C(F)(F)F)c4)cn3C)CC2)s1

Molecular Processing

Molecular formula
C25H24F4N6S
Molecular weight
516.57
Exact mass
516.1719
XLogP
6.04
TPSA
72.86
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
36
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.32
Molar refractivity
132.29

Supplementary Information

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