الاسم: compound 2
SMILES:
NC(=O)c1c(-c2ccc(Oc3ccccc3)cc2)nn2c1NCCC2c1cccc(NC(=O)CCCl)c1Molecular Processing
Molecular formula
C28H26ClN5O3
Molecular weight
516
Exact mass
515.1724
XLogP
5.41
TPSA
111.27
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
37
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.179
Molar refractivity
144.35
Supplementary Information
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