이름: 5-(2,5-diaza-bicyclo[2.2.1]hept-2-yl)-2-furan-2-yl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-ylamine
SMILES:
Nc1nc(N2CC3CC2CN3)nc2nc(-c3ccco3)nn12Molecular Processing
Molecular formula
C13H14N8O
Molecular weight
298.31
Exact mass
298.1291
XLogP
-0.09
TPSA
110.4
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
2
Heavy atoms
22
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
78.23
Supplementary Information
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