CC(C)C#CCCNC(=O)c1cnc(OCC(O)CNC(C)C)s1
SMILES: CC(C)C#CCCNC(=O)c1cnc(OCC(O)CNC(C)C)s1

Molecular Processing

Molecular formula
C17H27N3O3S
Molecular weight
353.49
Exact mass
353.1773
XLogP
1.66
TPSA
83.48
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.647
Molar refractivity
96.32

Supplementary Information

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