COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK072808
Chemical Name: 2-({(2E)-3-[1-(3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyanoprop-2-enoyl}amino)benzoicacid
Smiles: N#C/C(=C\c1cc(n(c1C)c1cccc(c1)Cl)C)/C(=O)Nc1ccccc1C(=O)O

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Molecular Weight: 419.87
Empirical Formula: C23H18ClN3O3

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 6.558
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 95
Number of rings: 3

     

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