SMILES:
Cc1ccc(-c2ccc(C(C)N3CCC(CC(C)(C)O)(c4ccccc4)OC3=O)cc2)nn1Molecular Processing
Molecular formula
C27H31N3O3
Molecular weight
445.56
Exact mass
445.2365
XLogP
5.41
TPSA
75.55
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.37
Molar refractivity
127.46
Supplementary Information
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