COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK871079
Chemical Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-4-(3-methylbutyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC(CCC1C(=NN(C1=O)c1nc2c(s1)cccc2)C)C

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Molecular Weight: 301.41
Empirical Formula: C16H19N3OS

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 3.69
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 73
Number of rings: 3

     

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