Loading ...
Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »

P-852176113

Product Show structure
In order to add this molecule to a collection you have to create an account.   Sign up for free
  1. InChIKey:
  2. SMILES:
  3. Formula:
  1. Get quote for multiple compounds
  2. Get custom quote


Name File
SDF P-852176113.sdf
SMILES P-852176113.smiles
Standard InChI P-852176113.inchi
InChIKey P-852176113.txt
Property Value
Components 1
Mass 296.145
logP 4.8166
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 3
PSA 49.33
RO5 violations 0
RO3 violations 1
Refractivity 77.931
Atoms 30
Rings 2
Heavy atoms 19
Hydrogen atoms 11
Heteroatoms 5
N/O atoms 3
Inorganic atoms 0
Halogen atoms 2
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
loader