COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741764
Chemical Name: 2-(1,3-benzothiazol-2-yl)-4-{(E)-[(4-methoxybenzyl)imino]methyl}-5-propyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCCc1[nH]n(c(=O)c1/C=N/Cc1ccc(cc1)OC)c1nc2c(s1)cccc2

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Molecular Weight: 406.51
Empirical Formula: C22H22N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.616
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 4

     

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