Name: 4-(4-ethyl-piperazin-1-yl)-but-2-ynoic acid
SMILES:
CCN1CCN(CC#CC(=O)O)CC1Molecular Processing
Molecular formula
C10H16N2O2
Molecular weight
196.25
Exact mass
196.1212
XLogP
-0.29
TPSA
43.78
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
53.97
Supplementary Information
Details werden geladen…
An 8 Reaktionen beteiligt→