SMILES:
Nc1ncc(-c2ccc(C(=O)NCC(O)CN3CCCC3)cc2)cc1OCc1c(Cl)cccc1ClMolecular Processing
Molecular formula
C26H28Cl2N4O3
Molecular weight
515.44
Exact mass
514.1538
XLogP
4.4
TPSA
100.71
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
138.89
Supplementary Information
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