SMILES:
CC(C)(C)OC(=O)N1CCC(Oc2cc(N3CCCCC3)ccc2C(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cn2)CC1Molecular Processing
Molecular formula
C34H40ClN5O5
Molecular weight
634.18
Exact mass
633.2718
XLogP
7.01
TPSA
113.1
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
45
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
175.56
Supplementary Information
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