COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK032057
Chemical Name: (6E)-6-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3,5-dimethoxybenzylidene)-5-imino-2-(phenoxymethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCC(c1ccc(cc1)OCCOc1c(OC)cc(cc1OC)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1)C

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Saltdata: HCI
Molecular Weight: 614.72
Empirical Formula: C33H34N4O6S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 5.596
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 140
Number of rings: 5

     

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