Name: Nalmefene Hydrochloride
SMILES:
C=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5.ClMolecular Processing
Molecular formula
C21H26ClNO3
Molecular weight
375.9
Exact mass
375.1601
XLogP
2.93
TPSA
52.93
H-bond donors
2
H-bond acceptors
4
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
5
Covalent units
2
Fraction Csp3
0.619
Molar refractivity
101.18
Supplementary Information
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