SMILES:
CCCN(CCC)Cc1csc(-c2ncn3c2C2CCN2C(=O)c2ccccc2-3)n1Molecular Processing
Molecular formula
C23H27N5OS
Molecular weight
421.57
Exact mass
421.1936
XLogP
4.52
TPSA
54.26
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
30
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
118.93
Supplementary Information
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