Name: 1-[trans-3-(hydroxymethyl)cyclohexyl]-3,6-dihydroimidazo[4,5-d]pyrrolo[2,3-b]pyridin-2(1H)-one
SMILES:
O=c1[nH]c2cnc3[nH]ccc3c2n1[C@H]1CCC[C@H](CO)C1Molecular Processing
Molecular formula
C15H18N4O2
Molecular weight
286.33
Exact mass
286.143
XLogP
1.93
TPSA
86.7
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
21
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
80.29
Supplementary Information
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