SMILES:
COCCc1ccc(OCC(O)CNCCOc2ccc(-n3ccnc3)cc2)cc1Molecular Processing
Molecular formula
C23H29N3O4
Molecular weight
411.5
Exact mass
411.2158
XLogP
2.47
TPSA
77.77
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
13
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
115.45
Supplementary Information
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