COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183204
Chemical Name: (2E)-2-cyano-3-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-N-(furan-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1sc(c(c1C#N)C)C)C)/C(=O)NCc1ccco1

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Molecular Weight: 404.49
Empirical Formula: C22H20N4O2S

Physical State: Dry powder
Available Amount: 440 mg

Lipinsky:
logP: 3.876
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 122
Number of rings: 3

     

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