SMILES:
CN1CCN(C2CCC(n3nc(-c4ccc(NC(=O)Cc5ccccc5)cc4)c4c(N)ncnc43)CC2)CC1Molecular Processing
Molecular formula
C30H36N8O
Molecular weight
524.67
Exact mass
524.3012
XLogP
3.99
TPSA
105.2
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
39
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
154.31
Supplementary Information
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