SMILES:
CC(C)N1CCC(Oc2ccc3c(c2)cc(C(=O)N2CCC(F)(F)CC2)n3-c2ccc(Cl)nc2)CC1Molecular Processing
Molecular formula
C27H31ClF2N4O2
Molecular weight
517.02
Exact mass
516.2104
XLogP
5.8
TPSA
50.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.481
Molar refractivity
136.52
Supplementary Information
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