الاسم: 8-fluoro-5-methyl-6-oxo-5,6-dihydro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carbonitrile
SMILES:
CN1Cc2c(C#N)ncn2-c2ccc(F)cc2C1=OMolecular Processing
Molecular formula
C13H9FN4O
Molecular weight
256.24
Exact mass
256.076
XLogP
1.47
TPSA
61.92
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
64.03
Supplementary Information
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