COc1cc2c(Oc3cc(C)c(C)nc3-c3ccc(C)cn3)ccnc2cc1OCC(O)CO
SMILES: COc1cc2c(Oc3cc(C)c(C)nc3-c3ccc(C)cn3)ccnc2cc1OCC(O)CO

Molecular Processing

Molecular formula
C26H27N3O5
Molecular weight
461.52
Exact mass
461.1951
XLogP
4.15
TPSA
106.82
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
34
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.269
Molar refractivity
128.64

Supplementary Information

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