O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CCC2)[C@H]1O5
Name: N-(cyclobutylmethyl)-noroxymorphone
SMILES: O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CCC2)[C@H]1O5

Molecular Processing

Molecular formula
C21H25NO4
Molecular weight
355.43
Exact mass
355.1784
XLogP
1.92
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
5
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
94.41

Supplementary Information

Details werden geladen…

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