COc1ccc(N2CCN(c3c(C)c(C)c4c(c3C)C(OCc3ccc(C(=O)O)cc3)C(C)(C)O4)CC2)cc1
SMILES: COc1ccc(N2CCN(c3c(C)c(C)c4c(c3C)C(OCc3ccc(C(=O)O)cc3)C(C)(C)O4)CC2)cc1

Molecular Processing

Molecular formula
C32H38N2O5
Molecular weight
530.67
Exact mass
530.2781
XLogP
6.07
TPSA
71.47
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
39
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.406
Molar refractivity
153.71

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→