이름: 5'-pyridin-3-ylspiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]pyridine]
SMILES:
C1CN2CCC1C3(C2)CC4=C(O3)N=CC(=C4)C5=CN=CC=C5Molecular Processing
Molecular formula
C18H19N3O
Molecular weight
293.37
Exact mass
293.1528
XLogP
2.54
TPSA
38.25
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
22
Rings
6
Aromatic rings
2
Saturated rings
3
Aliphatic rings
4
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
83.7
Supplementary Information
InChIKey: QKBVBFGEWWSUMM-UHFFFAOYSA-N
동의어
SCHEMBL373213QKBVBFGEWWSUMM-UHFFFAOYSA-N5'-(3-Pyridyl)spiro[1-azabicyclo[2.2.2]octane-3,2'(3 'H)-furo[2,3-b]pyridine]5'-(3-Pyridyl)spiro[1-azabicyclo[2.2.2]octane-3,2'(3'H)-furo[2,3-b]pyridine]
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