CC(C)(C)OC(=O)Nc1ccc2c(c1)Sc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2
SMILES: CC(C)(C)OC(=O)Nc1ccc2c(c1)Sc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2

Molecular Processing

Molecular formula
C26H26N2O5S2
Molecular weight
510.64
Exact mass
510.1283
XLogP
6.11
TPSA
81.01
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
3
Heavy atoms
35
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
137.99

Supplementary Information

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