COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741743
Chemical Name: 2-(1,3-benzothiazol-2-yl)-4-{(E)-[(2-phenoxyphenyl)imino]methyl}-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
Smiles: O=c1n([nH]c(c1/C=N/c1ccccc1Oc1ccccc1)C(F)(F)F)c1nc2c(s1)cccc2

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Molecular Weight: 480.47
Empirical Formula: C24H15F3N4O2S

Physical State: Dry powder
Available Amount: 540 mg

Lipinsky:
logP: 9.196
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 5

     

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