Name: 4-(tert-butoxycarbonylamino)-1-(6-(5-(pyridin-3-yl)-1-(tetrahydro-2H-pyran-2-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl)pyridin-2-yl)piperidine-4-carboxylic acid
SMILES:
CC(C)(C)OC(=O)NC1(C(=O)O)CCN(c2cccc(-c3nn(C4CCCCO4)c4cnc(-c5cccnc5)cc34)n2)CC1Molecular Processing
Molecular formula
C32H37N7O5
Molecular weight
599.69
Exact mass
599.2856
XLogP
5.2
TPSA
144.59
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
44
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
164.01
Supplementary Information
Details werden geladen…
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