SMILES:
Cc1cnc(NCCN2CCNC2=O)nc1-c1ccc(-c2cccs2)s1Molecular Processing
Molecular formula
C18H19N5OS2
Molecular weight
385.52
Exact mass
385.1031
XLogP
3.68
TPSA
70.15
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
26
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
106.86
Supplementary Information
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