COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183164
Chemical Name: 4-({2-chloro-4-[(1Z)-2-cyano-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-1-yl]-6-ethoxyphenoxy}methyl)benzoicacid
Smiles: CCOc1cc(/C=C(\C(=O)NCCc2c[nH]c3c2cccc3)/C#N)cc(c1OCc1ccc(cc1)C(=O)O)Cl

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Molecular Weight: 544.01
Empirical Formula: C30H26ClN3O5

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 5.568
Rotatable bonds: 10
H-donors: 3
H-acceptors: 5
PSA: 124
Number of rings: 4

     

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