SMILES:
COc1ccc2c(n1)N(CC(CO)N1CCC(N(Cc3cc4c(cn3)OCCO4)C(=O)OC(C)(C)C)CC1)C(=O)CC2Molecular Processing
Molecular formula
C30H41N5O7
Molecular weight
583.69
Exact mass
583.3006
XLogP
2.8
TPSA
126.79
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
8
Heavy atoms
42
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
153.94
Supplementary Information
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