SMILES:
Cc1cc(N(CCCN(C)Cc2ccc3c(c2)OCO3)CC(=O)O)nc(-n2ccnc2)n1Molecular Processing
Molecular formula
C22H26N6O4
Molecular weight
438.49
Exact mass
438.2016
XLogP
2.11
TPSA
105.84
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
117.26
Supplementary Information
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