O=C(O)C12CCC(c3nc(-c4ccc(F)cc4)no3)(CC1)CC2
Name: acid ( 7-C )
SMILES: O=C(O)C12CCC(c3nc(-c4ccc(F)cc4)no3)(CC1)CC2

Molecular Processing

Molecular formula
C17H17FN2O3
Molecular weight
316.33
Exact mass
316.1223
XLogP
3.55
TPSA
76.22
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
79.14

Supplementary Information

Details werden geladen…

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