Name: 6-mercaptopurine monohydrate
SMILES:
O.Sc1ncnc2nc[nH]c12Molecular Processing
Molecular formula
C5H6N4OS
Molecular weight
170.2
Exact mass
170.0262
XLogP
-0.18
TPSA
85.96
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0
Molar refractivity
42.55
Supplementary Information
Details werden geladen…
An 114 Reaktionen beteiligt→