SMILES:
Cc1nc(N2CCN(CC3CC3(F)F)C2=O)sc1C(=O)NCc1cccnc1Molecular Processing
Molecular formula
C18H19F2N5O2S
Molecular weight
407.45
Exact mass
407.1228
XLogP
2.67
TPSA
78.43
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
99.63
Supplementary Information
Details werden geladen…
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