Name: trans-6-(3-fluorophenyl)-N-[4-hydroxypyrrolidin-3-yl]nicotinamide
SMILES:
O=C(N[C@@H]1CNC[C@H]1O)c1ccc(-c2cccc(F)c2)nc1Molecular Processing
Molecular formula
C16H16FN3O2
Molecular weight
301.32
Exact mass
301.1227
XLogP
0.95
TPSA
74.25
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
79.76
Supplementary Information
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