SMILES:
Cc1ccc2c(c1)c1c(n2-c2cscn2)CCN(C)C1Molecular Processing
Molecular formula
C16H17N3S
Molecular weight
283.4
Exact mass
283.1143
XLogP
3.38
TPSA
21.06
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
20
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
83.72
Supplementary Information
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