SMILES:
CCC(c1c[nH]c2ccccc12)N1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1Molecular Processing
Molecular formula
C28H30ClN3
Molecular weight
444.02
Exact mass
443.2128
XLogP
6.68
TPSA
22.27
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
32
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
134.21
Supplementary Information
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