COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL030946
Chemical Name: ethylN-(thioxomethylidene)phenylalaninate
Smiles: CCOC(=O)C(Cc1ccccc1)N=C=S

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Molecular Weight: 235.31
Empirical Formula: C12H13NO2S

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 4.076
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 70
Number of rings: 1

     

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