Name: (E)-1-(tetrahydro-2H-pyran-2-yl)-3-(2-(1-(2-(tetrahydro-2H-pyran-2-yloxy)ethyl)-1H-pyrazol-4-yl)vinyl)-1H-indazol-5-ol
SMILES:
Oc1ccc2c(c1)c(/C=C/c1cnn(CCOC3CCCCO3)c1)nn2C1CCCCO1Molecular Processing
Molecular formula
C24H30N4O4
Molecular weight
438.53
Exact mass
438.2267
XLogP
4.35
TPSA
83.56
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
32
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
120.94
Supplementary Information
Details werden geladen…
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