COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK040655
Chemical Name: (6Z)-5-imino-2-(4-methylphenyl)-6-[(1-{2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1ccc(cc1)c1nn2c(=NC(=O)/C(=C\c3cn(c4c3cccc4)CCOc3ccc(cc3)C(c3ccccc3)(C)C)/C2=N)s1

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Molecular Weight: 623.78
Empirical Formula: C38H33N5O2S

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 7.883
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 108
Number of rings: 7

     

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