COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL446473
Chemical Name: (3Z)-1-(1,3-benzoxazol-2-yl)-3-[2-(3-chloro-4-fluorophenyl)hydrazinylidene]-5-methyl-4-(trifluoromethyl)-1,3-dihydro-2H-pyrrole-2-thione
Smiles: S=C1N(c2nc3c(o2)cccc3)C(=C(/C/1=N/Nc1ccc(c(c1)Cl)F)C(F)(F)F)C

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Molecular Weight: 454.84
Empirical Formula: C19H11ClF4N4OS

Physical State: Dry powder
Available Amount: 216 mg

Lipinsky:
logP: 7.773
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 4

     

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