CCNC(=O)Nc1ccc(-c2nc3c(c(N4CCOCC4C)n2)CCN(CC2COC(C)(C)O2)C3)cc1
SMILES: CCNC(=O)Nc1ccc(-c2nc3c(c(N4CCOCC4C)n2)CCN(CC2COC(C)(C)O2)C3)cc1

Molecular Processing

Molecular formula
C27H38N6O4
Molecular weight
510.64
Exact mass
510.2955
XLogP
3.02
TPSA
101.08
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
37
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.593
Molar refractivity
141.68

Supplementary Information

Details werden geladen…

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