이름: 7-hydroxy-2-(trifluoromethyl)-6,11-dihydro-5H-pyrido[2,3-b][1,5]benzodiazepin-5-one
SMILES:
O=C1Nc2c(O)cccc2Nc2nc(C(F)(F)F)ccc21Molecular Processing
Molecular formula
C13H8F3N3O2
Molecular weight
295.22
Exact mass
295.0569
XLogP
3.12
TPSA
74.25
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
68.58
Supplementary Information
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