COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020542
Chemical Name: 2-{(Z)-[5-imino-7-oxo-2-(trifluoromethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenyl4-methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F

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Molecular Weight: 494.47
Empirical Formula: C20H13F3N4O4S2

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 3.669
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 4

     

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