SMILES:
COc1cc(-c2cn3ccc(C)cc3n2)ccc1OCCCN1CCCCC1Molecular Processing
Molecular formula
C23H29N3O2
Molecular weight
379.5
Exact mass
379.226
XLogP
4.57
TPSA
39
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
112.32
Supplementary Information
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