COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK081695
Chemical Name: 3-(2-methylprop-2-en-1-yl)-2-[(4-nitrobenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CC(=C)Cn1c(SCc2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

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Molecular Weight: 473.6
Empirical Formula: C27H27N3O3S

Available Amount: 0 mg

Lipinsky:
logP: 7.419
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 103
Number of rings: 5

     

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