COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526814
Chemical Name: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

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Molecular Weight: 543.09
Empirical Formula: C31H27ClN2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.363
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 84
Number of rings: 6

     

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