이름: (6aR,9aS)-5,6a,7,8,9,9a-hexahydro-5-methyl-2-(4-(6-fluoropyridin-2-yl)benzyl)-cyclopent[4,5]imidazo[1,2-a]pyrazolo[4,3-e]pyrimidin-4(2H)-one
SMILES:
CN1C(=O)c2cn(Cc3ccc(-c4cccc(F)n4)cc3)nc2N2C1=N[C@@H]1CCC[C@@H]12Molecular Processing
Molecular formula
C23H21FN6O
Molecular weight
416.46
Exact mass
416.1761
XLogP
3.32
TPSA
66.62
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
31
Rings
6
Aromatic rings
3
Saturated rings
1
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
114.39
Supplementary Information
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