SMILES:
Cc1cccc(C(=O)NC(Nc2c(Nc3cccnc3)c(=O)c2=O)C(C)(C)Cc2ccncc2)c1Molecular Processing
Molecular formula
C27H27N5O3
Molecular weight
469.55
Exact mass
469.2114
XLogP
3.56
TPSA
113.08
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
136.65
Supplementary Information
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