SMILES:
CCc1cc(O)c(F)cc1-c1ccc2c(-c3nc4c([nH]3)CCN(Cc3ccc(Oc5ccccc5)nc3)C4)n[nH]c2c1Molecular Processing
Molecular formula
C33H29FN6O2
Molecular weight
560.63
Exact mass
560.2336
XLogP
6.77
TPSA
102.95
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
42
Rings
7
Aromatic rings
6
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
158.68
Supplementary Information
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