SMILES:
COC(=O)CCCn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21Molecular Processing
Molecular formula
C24H26FN5O3
Molecular weight
451.5
Exact mass
451.202
XLogP
3.21
TPSA
116.15
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
121.29
Supplementary Information
Récupération des détails…
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