COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434574
Chemical Name: methyl2-({(2E)-2-cyano-3-[3-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enoyl}amino)-5-propylthiophene-3-carboxylate
Smiles: CCCc1sc(c(c1)C(=O)OC)NC(=O)/C(=C/c1c[nH]nc1c1ccc(cc1)CC)/C#N

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Molecular Weight: 448.55
Empirical Formula: C24H24N4O3S

Physical State: Dry powder
Available Amount: 805 mg

Lipinsky:
logP: 7.316
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 136
Number of rings: 3

     

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