CN1CCN(c2ccc(C(=O)NC3CCC(CCN4CCC(C(=O)c5ccc(F)cc5)CC4)CC3)nc2)CC1
SMILES: CN1CCN(c2ccc(C(=O)NC3CCC(CCN4CCC(C(=O)c5ccc(F)cc5)CC4)CC3)nc2)CC1

Molecular Processing

Molecular formula
C31H42FN5O2
Molecular weight
535.71
Exact mass
535.3323
XLogP
4.25
TPSA
68.78
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
39
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.581
Molar refractivity
151.67

Supplementary Information

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