COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564410
Chemical Name: 1-(1,3-benzothiazol-2-yl)-3-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(1E)-N-(2-ethoxyphenyl)ethanimidoyl]-1H-pyrazol-5-ol
Smiles: CCOc1ccccc1/N=C(/c1c(CSc2ccc(cc2)Cl)nn(c1O)c1nc2c(s1)cccc2)\C

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Molecular Weight: 535.09
Empirical Formula: C27H23ClN4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.863
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 126
Number of rings: 5

     

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