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

P-580450409

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-580450409.sdf
SMILES P-580450409.smiles
Standard InChI P-580450409.inchi
InChIKey P-580450409.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580450409 CliniSciences S.A.S All products 99 in stock
Property Value
Components 1
Mass 125.150
logP 0.614
H-bond acceptors 4
H-bond donors 2
Rotatable bonds 2
PSA 88.77
RO5 violations 0
RO3 violations 2
Refractivity 24.9712
Atoms 14
Rings 0
Heavy atoms 7
Hydrogen atoms 7
Heteroatoms 5
N/O atoms 4
Inorganic atoms 0
Halogen atoms 0
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