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

MCULE-5175586009-0

Structure Show compound

In order to add this molecule to a collection you have to create an account. Sign up for free

1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
Property calculator Create a physicochemical property profile for the compound in a second.
Similarity search Find analogs by similarity search.
Substructure search Find analogs by substructure search.

mcule product ID	Supplier	Catalog	Guaranteed purity (%)	Product matching	Availability
P-611498540	Toronto Research	In stock	90	As is	in stock
P-611460677	Toronto Research	In stock	90	As is	in stock
P-611357184	Toronto Research	In stock	90	Main component as a main component	in stock

Property	Value
Components	3
Mass	231.204
logP	3.516
H-bond acceptors	2
H-bond donors	1
Rotatable bonds	6
PSA	26.02
RO5 violations	0
RO3 violations	2
Refractivity	64.3888
Atoms	37
Rings	0
Heavy atoms	13
Hydrogen atoms	24
Heteroatoms	4
N/O atoms	2
Inorganic atoms	0
Halogen atoms	2
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