SMILES:
Cc1cncc(C(=O)Nc2cccc(CN3CCC(C(=O)O)CC3C)c2)c1Molecular Processing
Molecular formula
C21H25N3O3
Molecular weight
367.45
Exact mass
367.1896
XLogP
3.33
TPSA
82.53
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
103.6
Supplementary Information
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