SMILES:
Cc1ccnc2c1C(=NNC(=N)N)CC(c1ccsc1)C2Molecular Processing
Molecular formula
C15H17N5S
Molecular weight
299.4
Exact mass
299.1205
XLogP
2.37
TPSA
87.15
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
85.94
Supplementary Information
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