SMILES:
CC(C)c1cc(N)c(N)cc1SC#NMolecular Processing
Molecular formula
C10H13N3S
Molecular weight
207.3
Exact mass
207.083
XLogP
2.55
TPSA
75.83
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
60.83
Supplementary Information
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