COc1ccc2ncccc2c1NC(N)=S
SMILES: COc1ccc2ncccc2c1NC(N)=S

Molecular Processing

Molecular formula
C11H11N3OS
Molecular weight
233.3
Exact mass
233.0623
XLogP
1.9
TPSA
60.17
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
68.7

Supplementary Information

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