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

P-34656800

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-34656800.sdf
SMILES P-34656800.smiles
Standard InChI P-34656800.inchi
InChIKey P-34656800.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-34656800 Crea-Chim HTS compounds 90 unavailable
Property Value
Components 1
Mass 419.346
logP 6.131
H-bond acceptors 4
H-bond donors 2
Rotatable bonds 5
PSA 96.25
RO5 violations 1
RO3 violations 5
Refractivity 93.2086
Atoms 39
Rings 3
Heavy atoms 28
Hydrogen atoms 11
Heteroatoms 11
N/O atoms 4
Inorganic atoms 0
Halogen atoms 6
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