SMILES:
CCCCCCCCOc1c(Cl)c(Sc2ccccc2N)c(OCCCCCCCC)c2c1C(=N)NC2=NMolecular Processing
Molecular formula
C30H43ClN4O2S
Molecular weight
559.22
Exact mass
558.2795
XLogP
8.81
TPSA
104.21
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
18
Heavy atoms
38
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
160.96
Supplementary Information
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