SMILES:
CCc1ccc(-c2nc(SCc3ccccn3)n[nH]2)c(C)c1Molecular Processing
Molecular formula
C17H18N4S
Molecular weight
310.43
Exact mass
310.1252
XLogP
4.03
TPSA
54.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
89.73
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→