Name: N-(1-(5-fluoropyridin-3-yl)-3-(hydroxymethyl)-1H-pyrazol-4-yl)isobutyramide
SMILES:
CC(C)C(=O)Nc1cn(-c2cncc(F)c2)nc1COMolecular Processing
Molecular formula
C13H15FN4O2
Molecular weight
278.29
Exact mass
278.1179
XLogP
1.49
TPSA
80.04
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
70.71
Supplementary Information
Details werden geladen…
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