COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017526
Chemical Name: (6Z)-2-(2-chlorophenyl)-5-imino-6-(3-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}benzylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1ccc(c(c1)OCCOc1cccc(c1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccccc1Cl)C(C)C

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Saltdata: HCl
Molecular Weight: 559.09
Empirical Formula: C30H27ClN4O3S

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 6.642
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 5

     

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