이름: (3S)-spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]pyridine]-5'-amine
SMILES:
C1CN2CCC1C3(C2)CC4=C(O3)N=CC(=C4)NMolecular Processing
Molecular formula
C13H17N3O
Molecular weight
231.3
Exact mass
231.1372
XLogP
1.06
TPSA
51.38
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
17
Rings
5
Aromatic rings
1
Saturated rings
3
Aliphatic rings
4
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
64.88
Supplementary Information
InChIKey: SWFYVZKNABTMPR-CYBMUJFWSA-N
동의어
SCHEMBL4504125SWFYVZKNABTMPR-CYBMUJFWSA-NG61790(2S)-3H-4-AZASPIRO[BICYCLO[2.2.2]OCTANE-2,2-FURO[2,3-B]PYRIDIN]-5-AMINE(S)-(+)-5'-Aminospiro[1-azabicyclo-[2.2.2]octane-3,2'(3'H)-furo[2,3-b]pyridine]
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