COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK041087
Chemical Name: 2-[(4-{(Z)-[2-(2-chlorophenyl)-5-imino-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}-2-ethoxyphenoxy)methyl]benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccccc1Cl

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Molecular Weight: 542.02
Empirical Formula: C28H20ClN5O3S

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 4.642
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 136
Number of rings: 5

     

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