COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531307
Chemical Name: ethyl4'-({[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetyl}amino)-1'H-spiro[cyclohexane-1,2'-naphthalene]-3'-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)CSc2nc3c4ccccc4CC4(c3c(=O)n2Cc2ccccc2)CCCCC4)c2c(CC31CCCCC3)cccc2

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Molecular Weight: 713.94
Empirical Formula: C44H47N3O4S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 12.024
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 8

     

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