O=C1CCc2cc(/C=C/C(=O)N3CC(OCc4nccs4)C3)cnc2N1
SMILES: O=C1CCc2cc(/C=C/C(=O)N3CC(OCc4nccs4)C3)cnc2N1

Molecular Processing

Molecular formula
C18H18N4O3S
Molecular weight
370.43
Exact mass
370.11
XLogP
1.86
TPSA
84.42
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
26
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
97.49

Supplementary Information

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