COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563695
Chemical Name: 1-(1,3-benzothiazol-2-yl)-4-[(1E)-N-(4-methylpiperazin-1-yl)ethanimidoyl]-3-(trifluoromethyl)-1H-pyrazol-5-ol
Smiles: CN1CCN(CC1)/N=C(/c1c(O)n(nc1C(F)(F)F)c1nc2c(s1)cccc2)\C

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Molecular Weight: 424.45
Empirical Formula: C18H19F3N6OS

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 4.528
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 98
Number of rings: 4

     

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