COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK084528
Chemical Name: 4-{(Z)-[5-imino-2-(4-methylphenyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}-2-methoxyphenyl4-methylbenzenesulfonate
Smiles: COc1cc(ccc1OS(=O)(=O)c1ccc(cc1)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccc(cc1)C

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Molecular Weight: 546.63
Empirical Formula: C27H22N4O5S2

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 3.983
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 5

     

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