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

P-580726906

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-580726906.sdf
SMILES P-580726906.smiles
Standard InChI P-580726906.inchi
InChIKey P-580726906.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580726906 BLD pharm In-stock building blocks 99 unavailable
Property Value
Components 2
Mass 538.634
logP 3.5404
H-bond acceptors 10
H-bond donors 2
Rotatable bonds 10
PSA 123.51
RO5 violations 1
RO3 violations 5
Refractivity 156.8636
Atoms 77
Rings 4
Heavy atoms 39
Hydrogen atoms 38
Heteroatoms 10
N/O atoms 10
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 1
Cis/trans stereo double bonds 1
Unknown stereo double bonds 0
Undefined stereo double bonds 0
loader