C[C@@H](Nc1cc(C2CCN([C@H]3CCCNC3)CC2)ccc1Cl)c1ccc(Cl)cc1Cl
SMILES: C[C@@H](Nc1cc(C2CCN([C@H]3CCCNC3)CC2)ccc1Cl)c1ccc(Cl)cc1Cl

Molecular Processing

Molecular formula
C24H30Cl3N3
Molecular weight
466.88
Exact mass
465.1505
XLogP
6.75
TPSA
27.3
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
129.39

Supplementary Information

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