COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK547120
Chemical Name: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-butyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

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Molecular Weight: 551.55
Empirical Formula: C29H31BrN2O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.934
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 75
Number of rings: 5

     

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