SMILES:
COc1ccc2c(-c3ccc(C)s3)nnc(Cl)c2c1Molecular Processing
Molecular formula
C14H11ClN2OS
Molecular weight
290.78
Exact mass
290.0281
XLogP
4.33
TPSA
35.01
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
79.15
Supplementary Information
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