COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186505
Chemical Name: methyl3-{3-[(1Z)-3-(benzylamino)-2-cyano-3-oxoprop-1-en-1-yl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Smiles: N#C/C(=C/c1cc(n(c1C)c1cccc(c1)C(=O)OC)C)/C(=O)NCc1ccccc1

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Molecular Weight: 413.48
Empirical Formula: C25H23N3O3

Physical State: Dry powder
Available Amount: 245 mg

Lipinsky:
logP: 4.857
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 3

     

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