COc1ccc(N2CCN(c3c(C)c(C)c4c(c3C)C(C3CCCCC3)C(C)(C)O4)CC2)cc1
SMILES: COc1ccc(N2CCN(c3c(C)c(C)c4c(c3C)C(C3CCCCC3)C(C)(C)O4)CC2)cc1

Molecular Processing

Molecular formula
C30H42N2O2
Molecular weight
462.68
Exact mass
462.3246
XLogP
6.78
TPSA
24.94
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
34
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
142.1

Supplementary Information

Details werden geladen…

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