SMILES:
CCCCCCCCCCCNc1cc(-c2c(N)nc(N)nc2CC)ccc1ClMolecular Processing
Molecular formula
C23H36ClN5
Molecular weight
418.03
Exact mass
417.2659
XLogP
6.47
TPSA
89.85
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
13
Heavy atoms
29
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.565
Molar refractivity
126.4
Supplementary Information
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