COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540139
Chemical Name: (2Z)-2-(1,3-benzothiazol-2-yl)-3-hydroxy-4-(pentafluorophenoxy)but-2-enenitrile
Smiles: N#C/C(=C(\COc1c(F)c(F)c(c(c1F)F)F)/O)/c1nc2c(s1)cccc2

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Molecular Weight: 398.31
Empirical Formula: C17H7F5N2O2S

Physical State: Dry powder
Available Amount: 269 mg

Lipinsky:
logP: 5.481
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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