SMILES:
CCCC(=O)Nc1c(Cl)nc2ccccc2c1NCC1(O)CCSCC1Molecular Processing
Molecular formula
C19H24ClN3O2S
Molecular weight
393.94
Exact mass
393.1278
XLogP
4.3
TPSA
74.25
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
110.29
Supplementary Information
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