COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK881616
Chemical Name: N-{2-[(E)-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-cyanoethenyl]-4-(thiophen-2-yl)-1,3-thiazol-5-yl}furan-2-carboxamide
Smiles: N#C/C(=C\c1cc(Br)c(c(c1)OC)O)/c1nc(c(s1)NC(=O)c1ccco1)c1cccs1

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Saltdata: 2/3DMFA
Molecular Weight: 528.41
Empirical Formula: C22H14BrN3O4S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 5.813
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 164
Number of rings: 4

     

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