Cc1cnc(C2CN(C)Cc3ccc(Cl)nc3O2)s1
SMILES: Cc1cnc(C2CN(C)Cc3ccc(Cl)nc3O2)s1

Molecular Processing

Molecular formula
C13H14ClN3OS
Molecular weight
295.8
Exact mass
295.0546
XLogP
3.07
TPSA
38.25
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
19
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
0.385
Molar refractivity
75.8

Supplementary Information

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