이름: 2-[4-(2-chloro-3-ethoxy-phenoxy)-2-oxo-2,5-dihydro-pyrrol-1-yl]-4-fluoro-4-methyl-pentanoic acid [1-((R)-2,3-dihydroxy-propyl)-1H-pyrazol-3-yl]-amide
SMILES:
CCOc1cccc(OC2=CC(=O)N(C(CC(C)(C)F)C(=O)Nc3ccn(C[C@@H](O)CO)n3)C2)c1ClMolecular Processing
Molecular formula
C24H30ClFN4O6
Molecular weight
524.98
Exact mass
524.1838
XLogP
2.54
TPSA
126.15
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
12
Heavy atoms
36
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
130.59
Supplementary Information
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