COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK041524
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-{1-[(2-hydroxy-5-methylphenyl)amino]ethylidene}-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(c(c1)N/C(=C/1\C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1)/C)O

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Molecular Weight: 440.53
Empirical Formula: C25H20N4O2S

Physical State: Dry powder
Available Amount: 355 mg

Lipinsky:
logP: 5.436
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 106
Number of rings: 5

     

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