SMILES:
COc1cc2ncnc(Oc3ccc(NC(=O)NN4CCCCC4)cc3)c2cc1OCMolecular Processing
Molecular formula
C22H25N5O4
Molecular weight
423.47
Exact mass
423.1907
XLogP
3.96
TPSA
97.84
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
116.74
Supplementary Information
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