COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK532698
Chemical Name: 3-(4-methylphenyl)-2-({3-[(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]propyl}sulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1ccc(cc1)n1c(SCCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccccc2)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

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Molecular Weight: 803.1
Empirical Formula: C50H50N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 14.467
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 115
Number of rings: 10

     

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