COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434364
Chemical Name: methyl2-{[(2E)-2-cyano-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}-5-methylthiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)O)/C(=O)Nc1sc(cc1C(=O)OC)C

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Molecular Weight: 372.4
Empirical Formula: C18H16N2O5S

Physical State: Dry powder
Available Amount: 625 mg

Lipinsky:
logP: 4.483
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 136
Number of rings: 2

     

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