SMILES:
Cc1cc(-c2ccc(F)cc2)ccc1-n1c(CC2CCN(C(=O)C3CC3)C2)n[nH]c1=OMolecular Processing
Molecular formula
C24H25FN4O2
Molecular weight
420.49
Exact mass
420.1962
XLogP
3.48
TPSA
70.99
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
31
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
115.43
Supplementary Information
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