SMILES:
Clc1nc2c(-c3ccccc3)cccc2s1Molecular Processing
Molecular formula
C13H8ClNS
Molecular weight
245.73
Exact mass
245.0066
XLogP
4.62
TPSA
12.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
70.07
Supplementary Information
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