SMILES:
COc1cccc(OC2=CC(=O)N([C@@H](CC(C)C)C(=O)Nc3ccn(CC(C)(C)O)n3)C2)c1ClMolecular Processing
Molecular formula
C24H31ClN4O5
Molecular weight
490.99
Exact mass
490.1983
XLogP
3.47
TPSA
105.92
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
34
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
128.83
Supplementary Information
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