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

P-502385178

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-502385178.sdf
SMILES P-502385178.smiles
Standard InChI P-502385178.inchi
InChIKey P-502385178.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502385178 TimTec Building Block Collection 90 in stock
Property Value
Components 1
Mass 218.294
logP 3.3034
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 3
PSA 55.12
RO5 violations 0
RO3 violations 1
Refractivity 65.7636
Atoms 34
Rings 2
Heavy atoms 16
Hydrogen atoms 18
Heteroatoms 3
N/O atoms 3
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