COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK651783
Chemical Name: (6E)-5-imino-6-({1-[2-(3-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-(pentan-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCC(c1nn2c(=NC(=O)/C(=C/c3cn(c4c3cccc4)CCOc3cccc(c3)C)/C2=N)s1)CC

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Molecular Weight: 499.64
Empirical Formula: C28H29N5O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.387
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 108
Number of rings: 5

     

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