COc1ccccc1N1CCN(CCCNC(=O)C23CC4CC(CC(C4)C2)C3)CC1.COc1ccccc1N1CCN(CCCNC(=O)C23CC4CC(CC(C4)C2)C3)CC1.Cl.Cl.O
SMILES: COc1ccccc1N1CCN(CCCNC(=O)C23CC4CC(CC(C4)C2)C3)CC1.COc1ccccc1N1CCN(CCCNC(=O)C23CC4CC(CC(C4)C2)C3)CC1.Cl.Cl.O

Molecular Processing

Molecular formula
C50H78Cl2N6O5
Molecular weight
914.12
Exact mass
912.5411
XLogP
7.1
TPSA
121.12
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
14
Heavy atoms
63
Rings
12
Aromatic rings
2
Saturated rings
10
Aliphatic rings
10
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
5
Fraction Csp3
0.72
Molar refractivity
257.87

Supplementary Information

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