COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK611927
Chemical Name: (2E)-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{[(2Z)-5,5-dioxido-3-(prop-2-en-1-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}prop-2-enamide
Smiles: C=CCN1/C(=N/C=C(/C(=O)NCCc2ccc(c(c2)OC)OC)\C#N)/SC2C1CS(=O)(=O)C2

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Molecular Weight: 490.6
Empirical Formula: C22H26N4O5S2

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 0.399
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 154
Number of rings: 3

     

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