SMILES:
COc1cccc2c1C(NC1=Nc3ccc(NC(=O)C4CC4)cc3CO1)CC2Molecular Processing
Molecular formula
C22H23N3O3
Molecular weight
377.44
Exact mass
377.1739
XLogP
3.84
TPSA
71.95
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
28
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
106.87
Supplementary Information
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