COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK743020
Chemical Name: 6-[(7-bromo-5-nitro-2,1,3-benzothiadiazol-4-yl)sulfanyl]-9H-purine
Smiles: [O-][N+](=O)c1cc(Br)c2c(c1Sc1ncnc3c1nc[nH]3)nsn2

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Molecular Weight: 410.23
Empirical Formula: C11H4BrN7O2S2

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 3.229
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 179
Number of rings: 4

     

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