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  1. InChIKey:
  2. SMILES:
  3. Formula:
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1 mg 377 USD 90 38 working days Get Quote
5 mg 507 USD 90 38 working days Get Quote
10 mg 507 USD 90 38 working days Get Quote
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Name File
SDF P-638206428.sdf
SMILES P-638206428.smiles
Standard InChI P-638206428.inchi
InChIKey P-638206428.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-638206428 Otava Tangible screening compounds 90 by synthesis April 22, 2021
Property Value
Components 1
Mass 401.413
logP 2.6919
H-bond acceptors 7
H-bond donors 0
Rotatable bonds 4
PSA 75.35
RO5 violations 0
RO3 violations 4
Refractivity 112.79
Atoms 49
Rings 5
Heavy atoms 30
Hydrogen atoms 19
Heteroatoms 7
N/O atoms 7
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