SMILES:
CCSc1cc2c(cc1Cl)NCC2Molecular Processing
Molecular formula
C10H12ClNS
Molecular weight
213.73
Exact mass
213.0379
XLogP
3.42
TPSA
12.03
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
60.04
Supplementary Information
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