COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK909665
Chemical Name: methyl2-({[2-(benzylsulfanyl)-5-chloropyrimidin-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)SCc1ccccc1)\C

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Molecular Weight: 499.01
Empirical Formula: C23H19ClN4O3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 8.372
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 158
Number of rings: 3

     

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