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


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:
Amount Price  Help
Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
Guaranteed purity (%) Delivery time  Help
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
1 mg 102 USD 90 22 working days Get Quote
5 mg 117 USD 90 22 working days Get Quote
10 mg 131 USD 90 22 working days Get Quote
New customers are eligible for 10% discount if indicated at the time of ordering.
  1. Get quote for multiple compounds
  2. Get custom quote

Name File
SDF P-711049.sdf
SMILES P-711049.smiles
Standard InChI P-711049.inchi
InChIKey P-711049.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-711049 VITAS M CHEMICAL LIMITED Screening compounds 90 205 mg 11 hours ago
Property Value
Components 1
Mass 483.624
logP 5.6454
H-bond acceptors 7
H-bond donors 1
Rotatable bonds 12
PSA 105.53
RO5 violations 1
RO3 violations 5
Refractivity 143.027
Atoms 67
Rings 3
Heavy atoms 34
Hydrogen atoms 33
Heteroatoms 8
N/O atoms 7
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0