SMILES:
CN1C(=O)C(CC(=O)N2CCC(N3Cc4ccccc4NC3=O)CC2)SC1c1ccccc1Molecular Processing
Molecular formula
C25H28N4O3S
Molecular weight
464.59
Exact mass
464.1882
XLogP
3.69
TPSA
72.96
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
33
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
128.55
Supplementary Information
Récupération des détails…
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