COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL225009
Chemical Name: (6Z)-6-[(2,5-dimethyl-1H-indol-3-yl)methylidene]-5-imino-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\c3c(C)[nH]c4c3cc(C)cc4)/C2=N)s1)CC

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Molecular Weight: 393.51
Empirical Formula: C21H23N5OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.63
Rotatable bonds: 4
H-donors: 2
H-acceptors: 1
PSA: 109
Number of rings: 4

     

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