COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017972
Chemical Name: (6E)-2-ethyl-5-imino-6-[3-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OCc1cccc2c1cccc2)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CC

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Molecular Weight: 470.55
Empirical Formula: C26H22N4O3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.089
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 5

     

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