SMILES:
Cc1[nH]c2ccc(CCN(CC(C)C)CC(C)C)cc2c1C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C27H36N2O2
Molecular weight
420.6
Exact mass
420.2777
XLogP
5.99
TPSA
45.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
10
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
128.42
Supplementary Information
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