COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK007895
Chemical Name: (6E)-6-{4-[2-(2-chlorophenoxy)ethoxy]-3,5-dimethoxybenzylidene}-5-imino-2-pentyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCCCc1nn2c(=NC(=O)/C(=C/c3cc(OC)c(c(c3)OC)OCCOc3ccccc3Cl)/C2=N)s1

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Molecular Weight: 557.07
Empirical Formula: C27H29ClN4O5S

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 4.78
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 4

     

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