이름: phenylmethyl[((3S)-1-{(2S)-2-hydroxy-2-[6-(methyloxy)-1,5-naphthyridin-4-yl]ethyl}-3-pyrrolidinyl)methyl]carbamate
SMILES:
COc1ccc2nccc([C@H](O)CN3CC[C@@H](CNC(=O)OCc4ccccc4)C3)c2n1Molecular Processing
Molecular formula
C24H28N4O4
Molecular weight
436.51
Exact mass
436.2111
XLogP
2.92
TPSA
96.81
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
120.23
Supplementary Information
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