COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK032815
Chemical Name: 4-{(Z)-[5-imino-7-oxo-2-(trifluoromethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}-2-iodo-6-methoxyphenyl4-methylbenzenesulfonate
Smiles: COc1cc(cc(c1OS(=O)(=O)c1ccc(cc1)C)I)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F

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Molecular Weight: 650.4
Empirical Formula: C21H14F3IN4O5S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.07
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 4

     

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