名称: 4-{5-[2-amino-5-(1-methyl-1H-indol-5-yl)-pyridin-3-yl]-[1,3,4]oxadiazol-2-yl}-piperidine-1-carboxylic acid tert-butyl ester
SMILES:
Cn1ccc2cc(-c3cnc(N)c(-c4nnc(C5CCN(C(=O)OC(C)(C)C)CC5)o4)c3)ccc21Molecular Processing
Molecular formula
C26H30N6O3
Molecular weight
474.57
Exact mass
474.2379
XLogP
4.99
TPSA
112.3
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
35
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
133.64
Supplementary Information
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