COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL115840
Chemical Name: (2E)-3-(2,5-dimethoxyphenyl)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(OC)ccc1OC)/c1scc(n1)c1ccc(cc1)C

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Molecular Weight: 362.45
Empirical Formula: C21H18N2O2S

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 5.943
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 3

     

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