الاسم: ibogaine
SMILES:
CC[C@H]1C[C@H]2C[C@H]3c4[nH]c5ccc(OC)cc5c4CCN(C2)[C@@H]13Molecular Processing
Molecular formula
C20H26N2O
Molecular weight
310.44
Exact mass
310.2045
XLogP
3.94
TPSA
28.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
23
Rings
6
Aromatic rings
2
Saturated rings
3
Aliphatic rings
4
Stereo centers
5
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
93.16
Supplementary Information
No supplementary data available
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