COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK325850
Chemical Name: (10E)-10-{3,5-dibromo-4-[(4-nitrobenzyl)oxy]benzylidene}-7-(3-methoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Smiles: COc1cccc(c1)C1C2=C(N=c3n1c(=O)/c(=C\c1cc(Br)c(c(c1)Br)OCc1ccc(cc1)[N+](=O)[O-])/s3)c1c(CC2)cccc1

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Molecular Weight: 759.47
Empirical Formula: C35H25Br2N3O5S

Physical State: Dry powder
Available Amount: 396 mg

Lipinsky:
logP: 9.814
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 7

     

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