Cc1nc(NNC(=O)C(CC2CCCC2)CN(C=O)OCc2ccccc2)c(F)c(N2CCN(C)C(C)C2)n1
SMILES: Cc1nc(NNC(=O)C(CC2CCCC2)CN(C=O)OCc2ccccc2)c(F)c(N2CCN(C)C(C)C2)n1

Molecular Processing

Molecular formula
C28H40FN7O3
Molecular weight
541.67
Exact mass
541.3177
XLogP
3.29
TPSA
102.93
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
12
Heavy atoms
39
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
146.86

Supplementary Information

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