이름: 6-fluoro-4,4-dimethyl-2-(3-morpholin-4-yl-phenyl)-1,2,3,4-tetrahydro-quinoline-8-carboxylic acid
SMILES:
CC1(C)CC(c2cccc(N3CCOCC3)c2)Nc2c(C(=O)O)cc(F)cc21Molecular Processing
Molecular formula
C22H25FN2O3
Molecular weight
384.45
Exact mass
384.1849
XLogP
4.2
TPSA
61.8
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
106.84
Supplementary Information
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