COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473557
Chemical Name: ethyl2-{[(2E)-3-(4-tert-butylphenyl)-2-cyanoprop-2-enoyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1ccsc1NC(=O)/C(=C/c1ccc(cc1)C(C)(C)C)/C#N

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Molecular Weight: 382.48
Empirical Formula: C21H22N2O3S

Physical State: Dry powder
Available Amount: 209 mg

Lipinsky:
logP: 7.015
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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