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

P-596217468

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-596217468.sdf
SMILES P-596217468.smiles
Standard InChI P-596217468.inchi
InChIKey P-596217468.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-596217468 Asinex General screening catalog 90 unavailable
Property Value
Components 1
Mass 375.822
logP 4.1936
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 7
PSA 61.44
RO5 violations 0
RO3 violations 5
Refractivity 102.3324
Atoms 45
Rings 3
Heavy atoms 26
Hydrogen atoms 19
Heteroatoms 7
N/O atoms 5
Inorganic atoms 0
Halogen atoms 2
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
loader