COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK081131
Chemical Name: 4,4'-[(4-fluorophenyl)methanediyl]bis[1-(1,3-benzothiazol-2-yl)-3-methyl-1H-pyrazol-5-ol]
Smiles: Fc1ccc(cc1)C(c1c(C)nn(c1O)c1nc2c(s1)cccc2)c1c(C)nn(c1O)c1nc2c(s1)cccc2

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Saltdata: 2 CH3COOH
Molecular Weight: 568.66
Empirical Formula: C29H21FN6O2S2

Physical State: Dry powder
Available Amount: 773 mg

Lipinsky:
logP: 7.509
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 158
Number of rings: 7

     

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