SMILES:
Cl.Cn1c(CCc2ccc(C(=N)N)cc2)nc2cc(C(=O)N3c4ccccc4CC3C(=O)O)cnc21Molecular Processing
Molecular formula
C26H25ClN6O3
Molecular weight
504.98
Exact mass
504.1677
XLogP
3.12
TPSA
138.19
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
36
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
2
Fraction Csp3
0.192
Molar refractivity
139
Supplementary Information
Obteniendo detalles…
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