SMILES:
CN1C[C@H]2CCN(c3ccc(N4CCN(c5ccc(Cl)nn5)CC4)cc3)[C@H]2C1Molecular Processing
Molecular formula
C21H27ClN6
Molecular weight
398.94
Exact mass
398.1986
XLogP
2.6
TPSA
38.74
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
28
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.524
Molar refractivity
114.65
Supplementary Information
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Involved in 2 reactions→