COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK909659
Chemical Name: methyl2-({[5-chloro-2-(ethylsulfonyl)pyrimidin-4-yl]carbonyl}amino)-5-[(1E)-1-cyanoprop-1-en-2-yl]-4-methylthiophene-3-carboxylate
Smiles: N#C/C=C(/c1sc(c(c1C)C(=O)OC)NC(=O)c1nc(ncc1Cl)S(=O)(=O)CC)\C

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Molecular Weight: 468.94
Empirical Formula: C18H17ClN4O5S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 3.852
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 175
Number of rings: 2

     

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