COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK071113
Chemical Name: (6E)-6-[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)benzylidene]-5-imino-2-pentyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCCCc1sc2=NC(=O)/C(=C/c3cc(OC)c(c(c3)CC=C)O)/C(=N)n2n1

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Molecular Weight: 412.51
Empirical Formula: C21H24N4O3S

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 3.216
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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