SMILES:
N#CC1=C(NC(=S)NC(=O)c2ccccc2)CCCC1Molecular Processing
Molecular formula
C15H15N3OS
Molecular weight
285.37
Exact mass
285.0936
XLogP
2.64
TPSA
64.92
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
80.75
Supplementary Information
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