COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK838341
Chemical Name: (2E)-3-(1,3-benzodioxol-5-ylamino)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)OCO2)/c1scc(n1)c1ccc(cc1)Br

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Molecular Weight: 426.29
Empirical Formula: C19H12BrN3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.462
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 4

     

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