SMILES:
Cc1nc(CCc2c(-c3ccc(F)cn3)noc2C)sc1C(=O)NC1CCOCC1Molecular Processing
Molecular formula
C21H23FN4O3S
Molecular weight
430.51
Exact mass
430.1475
XLogP
3.64
TPSA
90.14
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
110
Supplementary Information
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