SMILES:
N#Cc1ccc(C2CCCc3cncn32)cc1Molecular Processing
Molecular formula
C14H13N3
Molecular weight
223.28
Exact mass
223.1109
XLogP
2.68
TPSA
41.61
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
17
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
64.46
Supplementary Information
Details werden geladen…
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