COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK142981
Chemical Name: 2-(1,3-benzothiazol-2-yl)-5-propyl-4-[(E)-(propylimino)methyl]-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCC/N=C/c1c(CCC)[nH]n(c1=O)c1nc2c(s1)cccc2

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Molecular Weight: 328.44
Empirical Formula: C17H20N4OS

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 4.933
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 3

     

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