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

MCULE-4288562987-0

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-33404680	TimTec	ActiMol 2 Week	90	As a main component	in stock
P-33404699	TimTec	ActiMol 2 Week	90	As a main component	in stock
P-33254589	TimTec	ActiMol 2 Week	90	As a main component	in stock
P-33404686	TimTec	ActiMol 2 Week	90	As a main component	in stock

Property	Value
Components	1
Mass	305.478
logP	4.5527
H-bond acceptors	3
H-bond donors	1
Rotatable bonds	13
PSA	32.98
RO5 violations	0
RO3 violations	3
Refractivity	95.9062
Atoms	55
Rings	1
Heavy atoms	22
Hydrogen atoms	33
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