SMILES:
CCN(CC)CCCN=C1c2ccccc2CSc2ccccc21Molecular Processing
Molecular formula
C21H26N2S
Molecular weight
338.52
Exact mass
338.1817
XLogP
4.86
TPSA
15.6
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
105.36
Supplementary Information
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