SMILES:
Nc1ccc(C(=O)CCC(=O)N2CCC(N3Cc4ccccc4NC3=O)CC2)cc1BrMolecular Processing
Molecular formula
C23H25BrN4O3
Molecular weight
485.38
Exact mass
484.111
XLogP
4.03
TPSA
95.74
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
31
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
122.72
Supplementary Information
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