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

MCULE-5895117546-0

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 461.980
logP 6.3946
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 10
PSA 62.3
RO5 violations 1
RO3 violations 5
Refractivity 135.1917
Atoms 61
Rings 3
Heavy atoms 33
Hydrogen atoms 28
Heteroatoms 6
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
loader