COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK096618
Chemical Name: (2Z)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(1,3-benzothiazol-2-yl)-2-(trifluoroacetyl)but-2-enehydrazide
Smiles: O=C(/C(=C(\N1CCN(CC1)Cc1ccc2c(c1)OCO2)/C)/C(=O)C(F)(F)F)N(c1nc2c(s1)cccc2)N

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Molecular Weight: 547.56
Empirical Formula: C25H24F3N5O4S

Physical State: Dry powder
Available Amount: 447 mg

Lipinsky:
logP: 6.677
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 5

     

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