SMILES:
COc1c2c(c3n(c1=O)CCC(N1CCCC1)CN(C)C3=O)CCN(Cc1ccc(F)c(Cl)c1)C2=OMolecular Processing
Molecular formula
C26H30ClFN4O4
Molecular weight
517
Exact mass
516.194
XLogP
2.79
TPSA
75.09
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
36
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
133.28
Supplementary Information
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