COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK014724
Chemical Name: (6E)-6-({1-[2-(2-chlorophenoxy)ethyl]-1H-pyrrol-3-yl}methylidene)-5-imino-2-(3-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1cccc(c1)c1sc2=NC(=O)/C(=C/c3ccn(c3)CCOc3ccccc3Cl)/C(=N)n2n1

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Molecular Weight: 489.98
Empirical Formula: C25H20ClN5O2S

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 4.413
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 108
Number of rings: 5

     

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