COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK902496
Chemical Name: (2E)-1-(3,4-dimethoxyphenyl)-3-{[3-(methylsulfanyl)phenyl]amino}prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/Nc1cccc(c1)SC

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Molecular Weight: 329.42
Empirical Formula: C18H19NO3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.667
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 72
Number of rings: 2

     

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