COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207130
Chemical Name: (2Z)-2-[1-(1,3-benzothiazol-2-yl)-3-{[(4-chlorophenyl)sulfanyl]methyl}-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-4-hydroxy-2H-quinolin-1-ide
Smiles: Clc1ccc(cc1)SCC1=NN(C(=O)/C/1=C\1/C=C(O)c2c([N-]1)cccc2)c1nc2c(s1)cccc2

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Saltdata: Na+
Molecular Weight: 516.02
Empirical Formula: C26H16ClN4O2S2

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 6.051
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 119
Number of rings: 6

     

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