SMILES:
Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N2CCSC2)cn1Molecular Processing
Molecular formula
C20H19N3O3S
Molecular weight
381.46
Exact mass
381.1147
XLogP
3.77
TPSA
68.46
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
27
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
103.61
Supplementary Information
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