SMILES:
C=CC(=O)NCc1cccc(Sc2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)c1Molecular Processing
Molecular formula
C24H25N5O2S
Molecular weight
447.56
Exact mass
447.1729
XLogP
4.01
TPSA
79.38
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.208
Molar refractivity
127.4
Supplementary Information
Obteniendo detalles…
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