COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK556075
Chemical Name: 12-(2-phenylethyl)-9-[(2-phenylethyl)sulfanyl]-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(12H)-one
Smiles: O=c1n2c(SCCc3ccccc3)nnc2n(c2c1C1(CCCC1)Cc1c2cccc1)CCc1ccccc1

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Molecular Weight: 532.71
Empirical Formula: C33H32N4OS

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 9.339
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 76
Number of rings: 7

     

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