COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531571
Chemical Name: 3-(4-methoxyphenyl)-2-[(3-{[3-(2-methylprop-2-en-1-yl)-4-oxo-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
Smiles: COc1ccc(cc1)n1c(SCCCSc2nc3c4ccccc4CC4(c3c(=O)n2CC(=C)C)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

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Molecular Weight: 797.1
Empirical Formula: C48H52N4O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 13.55
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 125
Number of rings: 9

     

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