SMILES:
CN(C)CCCOc1cccc2c1nc(C(F)F)n2-c1nc(N2CCOCC2)nc(N2CCN(S(C)(=O)=O)CC2)n1Molecular Processing
Molecular formula
C25H35F2N9O4S
Molecular weight
595.68
Exact mass
595.2501
XLogP
1.4
TPSA
122.05
H-bond donors
0
H-bond acceptors
11
Rotatable bonds
10
Heavy atoms
41
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
16
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
149.74
Supplementary Information
Details werden geladen…
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