COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK852081
Chemical Name: (2Z)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/c1cc(Br)c(c(c1)OC)O)/c1scc(n1)c1ccc(c(c1)OC)OC

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Molecular Weight: 473.35
Empirical Formula: C21H17BrN2O4S

Physical State: Dry powder
Available Amount: 290 mg

Lipinsky:
logP: 5.337
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 3

     

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