SMILES:
COc1cccc2c1N=C(SC)NC2CMolecular Processing
Molecular formula
C11H14N2OS
Molecular weight
222.31
Exact mass
222.0827
XLogP
2.71
TPSA
33.62
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
65.15
Supplementary Information
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