COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK754601
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-[1-(dimethylamino)ethylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C(/N(C)C)\C)c1nc2c(s1)cccc2

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Molecular Weight: 300.38
Empirical Formula: C15H16N4OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.975
Rotatable bonds: 0
H-donors: 0
H-acceptors: 1
PSA: 77
Number of rings: 3

     

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