SMILES:
COc1cc(CN[C@@H]2CO[C@H](C(c3ccccc3)c3ccccc3)C[C@H]2O)cc(OC)c1Molecular Processing
Molecular formula
C27H31NO4
Molecular weight
433.55
Exact mass
433.2253
XLogP
4.14
TPSA
59.95
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
125.26
Supplementary Information
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