SMILES:
C#Cc1ccc(CO)nc1NMolecular Processing
Molecular formula
C8H8N2O
Molecular weight
148.16
Exact mass
148.0637
XLogP
0.14
TPSA
59.14
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
42.51
Supplementary Information
상세 정보 불러오는 중…
6개 반응에 참여→