الاسم: 4-(8-(3-(trifluoromethyl)phenyl)-[1,2,4]-triazolo[1,5-a]pyridin-2-ylamino)benzoic acid
SMILES:
O=C(O)c1ccc(Nc2nc3c(-c4cccc(C(F)(F)F)c4)cccn3n2)cc1Molecular Processing
Molecular formula
C20H13F3N4O2
Molecular weight
398.34
Exact mass
398.0991
XLogP
4.86
TPSA
79.52
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
29
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.05
Molar refractivity
100.11
Supplementary Information
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