SMILES:
COc1ccc(Cn2cc(-c3nc(Nc4ccccn4)sc3C#N)cn2)cc1Molecular Processing
Molecular formula
C20H16N6OS
Molecular weight
388.46
Exact mass
388.1106
XLogP
4.07
TPSA
88.65
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
107.67
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→