COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK090686
Chemical Name: (2E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc2OCOc2cc1[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)Br

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Molecular Weight: 456.28
Empirical Formula: C19H10BrN3O4S

Available Amount: 0 mg

Lipinsky:
logP: 6.437
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 129
Number of rings: 4

     

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