SMILES:
Cc1cccc(NC(=O)C23CCC(NCC(=O)N4CC(F)CC4C#N)(CC2)CC3)c1Molecular Processing
Molecular formula
C23H29FN4O2
Molecular weight
412.51
Exact mass
412.2275
XLogP
3.08
TPSA
85.23
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
30
Rings
5
Aromatic rings
1
Saturated rings
4
Aliphatic rings
4
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.609
Molar refractivity
111.3
Supplementary Information
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