SMILES:
Cc1nc(NC(=N)N)sc1C(=O)Nc1cccc(OCC(=O)O)c1Molecular Processing
Molecular formula
C14H15N5O4S
Molecular weight
349.37
Exact mass
349.0845
XLogP
1.47
TPSA
150.42
H-bond donors
5
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
89.91
Supplementary Information
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