SMILES:
Cc1[nH]nc(N)c1-c1ccc(Sc2ccccc2)cc1Molecular Processing
Molecular formula
C16H15N3S
Molecular weight
281.38
Exact mass
281.0987
XLogP
4.12
TPSA
54.7
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
83.74
Supplementary Information
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