SMILES:
Cn1c(CCc2ccc(C(=N)NC(=O)c3ccccc3)cc2)nc2cc(C(=O)NN3CCC(NC(=O)c4ccccc4)CC3)ccc21Molecular Processing
Molecular formula
C37H37N7O3
Molecular weight
627.75
Exact mass
627.2958
XLogP
4.65
TPSA
132.21
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
47
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.216
Molar refractivity
181.27
Supplementary Information
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