SMILES:
COc1ccccc1Sc1ccc(-c2ccnc(N3CCN(C(C)=O)CC3)c2)cc1C(F)(F)FMolecular Processing
Molecular formula
C25H24F3N3O2S
Molecular weight
487.55
Exact mass
487.1541
XLogP
5.6
TPSA
45.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
34
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
0.28
Molar refractivity
126.26
Supplementary Information
Details werden geladen…
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