SMILES:
CCCCCCOC(=O)NC(=N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OC)c4ccccn4)ccc3n2C)cc1Molecular Processing
Molecular formula
C33H39N7O5
Molecular weight
613.72
Exact mass
613.3013
XLogP
5.42
TPSA
151.53
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
14
Heavy atoms
45
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
172.48
Supplementary Information
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