Name: compound 4
SMILES:
Nc1ncnc2c1ncn2[C@@H]1C[C@H](OC(=O)c2ccccc2)[C@H](COC(=O)c2ccccc2)O1Molecular Processing
Molecular formula
C24H21N5O5
Molecular weight
459.46
Exact mass
459.1543
XLogP
2.78
TPSA
131.45
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
34
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.208
Molar refractivity
120.63
Supplementary Information
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