COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK831343
Chemical Name: ethyl{[4-(4-methylphenyl)-5-oxo-5,7-dihydro-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-1-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccc(cc1)C)CCCCC3

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Molecular Weight: 514.65
Empirical Formula: C29H30N4O3S

Physical State: Dry powder
Available Amount: 423 mg

Lipinsky:
logP: 8.345
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 6

     

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