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

MCULE-2497356176-0

Structure Show compound
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


Property Value
Components 1
Mass 459.460
logP 3.3139
H-bond acceptors 11
H-bond donors 1
Rotatable bonds 4
PSA 200.82
RO5 violations 1
RO3 violations 5
Refractivity 116.7987
Atoms 44
Rings 4
Heavy atoms 31
Hydrogen atoms 13
Heteroatoms 13
N/O atoms 11
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 2
Cis/trans stereo double bonds 0
Unknown stereo double bonds 2
Undefined stereo double bonds 0
loader