SMILES:
COc1c(C)c(N2CCN(c3ccc4c(c3)OCCO4)CC2)c(C)c2c1OC(C)(C)C2Molecular Processing
Molecular formula
C25H32N2O4
Molecular weight
424.54
Exact mass
424.2362
XLogP
4.12
TPSA
43.4
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
31
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.52
Molar refractivity
122.74
Supplementary Information
Obteniendo detalles…
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