이름: naltrexone hydrochloride
SMILES:
Cl.O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5Molecular Processing
Molecular formula
C20H24ClNO4
Molecular weight
377.87
Exact mass
377.1394
XLogP
1.95
TPSA
70
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
26
Rings
6
Aromatic rings
1
Saturated rings
3
Aliphatic rings
5
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.65
Molar refractivity
97.05
Supplementary Information
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