COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL442123
Chemical Name: 2-[7-tert-butyl-3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-1,3-thiazole-4-carbothioamide
Smiles: NC(=S)c1csc(n1)N1N=C2C(C1(O)C(F)(F)F)CCCC2C(C)(C)C

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Molecular Weight: 406.5
Empirical Formula: C16H21F3N4OS2

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 2.726
Rotatable bonds: 2
H-donors: 3
H-acceptors: 1
PSA: 135
Number of rings: 3

     

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