SMILES:
CCNC(=S)N1CCN(c2ccc3ccccc3n2)CC1Molecular Processing
Molecular formula
C16H20N4S
Molecular weight
300.43
Exact mass
300.1409
XLogP
2.25
TPSA
31.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
91.8
Supplementary Information
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