COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK777082
Chemical Name: N-(2,4-dimethylphenyl)-2-[(4-ethyl-5-oxo-5,7-dihydro-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-1-yl)sulfanyl]acetamide
Smiles: CCn1c2nnc(n2c2c(c1=O)C1(CCCCC1)Cc1c2cccc1)SCC(=O)Nc1ccc(cc1C)C

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Molecular Weight: 527.69
Empirical Formula: C30H33N5O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.958
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 6

     

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