SMILES:
BrCc1ccc2sc3ccc4ccccc4c3c2c1Molecular Processing
Molecular formula
C17H11BrS
Molecular weight
327.25
Exact mass
325.9765
XLogP
6.1
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
19
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.059
Molar refractivity
89.47
Supplementary Information
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