SMILES:
Cc1cc(CC(NC(=O)N2CCC(N3CCc4ccccc4NC3=O)CC2)C(=O)O)cc(Cl)c1NMolecular Processing
Molecular formula
C25H30ClN5O4
Molecular weight
500
Exact mass
499.1986
XLogP
3.49
TPSA
128
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
35
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
134.73
Supplementary Information
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