COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK837789
Chemical Name: (2E)-3-(1,3-benzodioxol-5-ylamino)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc2c(c1)OCO2)/C#N

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Molecular Weight: 391.45
Empirical Formula: C21H17N3O3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.905
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 4

     

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