Название: (S)-2-[4-(2-fluoro-3-pyrrolidin-1-yl-phenoxy)-2-oxo-2,5-dihydro-pyrrol-1-yl]-4-methyl-pentanoic acid
SMILES:
CC(C)C[C@@H](C(=O)O)N1CC(Oc2cccc(N3CCCC3)c2F)=CC1=OMolecular Processing
Molecular formula
C20H25FN2O4
Molecular weight
376.43
Exact mass
376.1798
XLogP
3.03
TPSA
70.08
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
99.15
Supplementary Information
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