SMILES:
CN(C)CCC1CN(C)C(=S)c2cc(N)ccc2O1Molecular Processing
Molecular formula
C14H21N3OS
Molecular weight
279.41
Exact mass
279.1405
XLogP
1.59
TPSA
41.73
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
82.77
Supplementary Information
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