SMILES:
Cc1cccc(-c2sc(N)nc2-c2ccc3c(c2)OCO3)n1Molecular Processing
Molecular formula
C16H13N3O2S
Molecular weight
311.37
Exact mass
311.0728
XLogP
3.49
TPSA
70.26
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
22
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
86.05
Supplementary Information
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