SMILES:
CC(=O)Nc1ccc(Sc2ccc(Br)cc2Nc2ccnc3nc(C)ccc23)cc1Molecular Processing
Molecular formula
C23H19BrN4OS
Molecular weight
479.4
Exact mass
478.0463
XLogP
6.55
TPSA
66.91
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.087
Molar refractivity
126.57
Supplementary Information
Details werden geladen…
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