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

P-580752427

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-580752427.sdf
SMILES P-580752427.smiles
Standard InChI P-580752427.inchi
InChIKey P-580752427.txt
Property Value
Components 1
Mass 360.829
logP 4.68
H-bond acceptors 4
H-bond donors 0
Rotatable bonds 7
PSA 52.6
RO5 violations 0
RO3 violations 4
Refractivity 97.9835
Atoms 46
Rings 2
Heavy atoms 25
Hydrogen atoms 21
Heteroatoms 5
N/O atoms 4
Inorganic atoms 0
Halogen atoms 1
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