COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK079313
Chemical Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-(3-hydroxy-4-methoxybenzylidene)-5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1O)/C=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)CSc1ccc(cc1)C

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Molecular Weight: 487.6
Empirical Formula: C26H21N3O3S2

Physical State: Dry powder
Available Amount: 355 mg

Lipinsky:
logP: 6.153
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 128
Number of rings: 5

     

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