COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169431
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-{[(3-hydroxypropyl)amino]methylidene}-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: OCCCN/C=C/1\C(=NN(C1=O)c1nc2c(s1)cccc2)CCC

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Molecular Weight: 344.44
Empirical Formula: C17H20N4O2S

Physical State: Dry powder
Available Amount: 14 mg

Lipinsky:
logP: 2.607
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 106
Number of rings: 3

     

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