SMILES:
CCCCCCCCSc1nnc(-c2ccc3[nH]cnc3c2)o1Molecular Processing
Molecular formula
C17H22N4OS
Molecular weight
330.46
Exact mass
330.1514
XLogP
5.07
TPSA
67.6
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
93.49
Supplementary Information
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