SMILES:
Brc1ccc(CN(Cc2ccc(Br)cc2)c2ccc3[nH]cnc3c2)cc1Molecular Processing
Molecular formula
C21H17Br2N3
Molecular weight
471.2
Exact mass
468.9789
XLogP
6.29
TPSA
31.92
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
26
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.095
Molar refractivity
114.26
Supplementary Information
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