이름: (1R)-2-[(3S)-3-(aminomethyl)-1-pyrrolidinyl]-1-[3-fluoro-6-(methyloxy)-1,5-naphthyridin-4-yl]ethanol
SMILES:
COc1ccc2ncc(F)c([C@@H](O)CN3CC[C@@H](CN)C3)c2n1Molecular Processing
Molecular formula
C16H21FN4O2
Molecular weight
320.37
Exact mass
320.1649
XLogP
1.09
TPSA
84.5
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
84.61
Supplementary Information
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