SMILES:
CSc1nnc2ccc(N3CCCN(Cc4ccccc4)CC3)nn12Molecular Processing
Molecular formula
C18H22N6S
Molecular weight
354.48
Exact mass
354.1627
XLogP
2.56
TPSA
49.56
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
25
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.389
Molar refractivity
101.11
Supplementary Information
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