SMILES:
Cc1ccc(-c2cc(C(=O)N[C@H](C)c3cnc(C)nc3)cc(C(=O)N(C)CC(C)C)c2)cc1Molecular Processing
Molecular formula
C27H32N4O2
Molecular weight
444.58
Exact mass
444.2525
XLogP
4.98
TPSA
75.19
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
33
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
131.06
Supplementary Information
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