SMILES:
CN1CCN(c2ccnc(-c3ccsc3)c2)CC1Molecular Processing
Molecular formula
C14H17N3S
Molecular weight
259.38
Exact mass
259.1143
XLogP
2.56
TPSA
19.37
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
77.26
Supplementary Information
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