COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK548026
Chemical Name: methyl2-{[(2E)-3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccc(cc1)Cl)/C(=O)Nc1sc(c(c1C(=O)OC)C)C

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Molecular Weight: 374.85
Empirical Formula: C18H15ClN2O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.24
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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