COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114705
Chemical Name: (10E)-7-(2-methoxyphenyl)-10-[3-nitro-4-(4H-1,2,4-triazol-3-ylsulfanyl)benzylidene]-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Smiles: COc1ccccc1C1C2=C(N=c3n1c(=O)/c(=C\c1ccc(c(c1)[N+](=O)[O-])Sc1[nH]cnn1)/s3)c1c(CC2)cccc1

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Molecular Weight: 594.67
Empirical Formula: C30H22N6O4S2

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 7.2
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 179
Number of rings: 7

     

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