الاسم: compound
SMILES:
O=CO[C@H](CCc1ccccc1)[C@H](CCn1nnc2ccccc2c1=O)C(=O)OMolecular Processing
Molecular formula
C21H21N3O5
Molecular weight
395.42
Exact mass
395.1481
XLogP
2.06
TPSA
111.38
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
105.24
Supplementary Information
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