SMILES:
CC(C)(C)c1ccc(C(=O)NC(=S)Nc2ccc(NC(=O)CCCCCCCBr)cc2)cc1Molecular Processing
Molecular formula
C26H34BrN3O2S
Molecular weight
532.55
Exact mass
531.1555
XLogP
6.78
TPSA
70.23
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
10
Heavy atoms
33
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
145.4
Supplementary Information
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