COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531155
Chemical Name: 2,2'-(butane-1,4-diyldisulfanediyl)bis[3-(4-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one]
Smiles: Cc1ccc(cc1)n1c(SCCCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccc(cc2)C)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

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Molecular Weight: 831.16
Empirical Formula: C52H54N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 15.228
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 115
Number of rings: 10

     

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