SMILES:
C=CCOc1ccc(CSCCn2ccnn2)c(C)c1Molecular Processing
Molecular formula
C15H19N3OS
Molecular weight
289.4
Exact mass
289.1249
XLogP
3.08
TPSA
39.94
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
83.06
Supplementary Information
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