COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564578
Chemical Name: 1-(1,3-benzothiazol-2-yl)-4-[(1E)-N-(4-methoxybenzyl)ethanimidoyl]-3-(trifluoromethyl)-1H-pyrazol-5-ol
Smiles: COc1ccc(cc1)C/N=C(/c1c(O)n(nc1C(F)(F)F)c1nc2c(s1)cccc2)\C

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Molecular Weight: 446.45
Empirical Formula: C21H17F3N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.781
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 100
Number of rings: 4

     

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