COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016757
Chemical Name: 2-[(2-ethoxy-4-{(Z)-[5-imino-7-oxo-2-(phenoxymethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenoxy)methyl]benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1

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Molecular Weight: 537.6
Empirical Formula: C29H23N5O4S

Physical State: Dry powder
Available Amount: 267 mg

Lipinsky:
logP: 3.912
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 5

     

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