SMILES:
COc1cc(C(=O)N2CCC(CCO)(c3cccnc3)C2)cc(OC)c1OCMolecular Processing
Molecular formula
C21H26N2O5
Molecular weight
386.45
Exact mass
386.1842
XLogP
2.27
TPSA
81.12
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
104.24
Supplementary Information
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