COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL494658
Chemical Name: 7-bromo-5-chloro-3'-methyl-1-(prop-2-yn-1-yl)-1'-(7H-purin-6-yl)-1',7'-dihydrospiro[indole-3,4'-pyrazolo[3,4-b]pyridine]-2,6'(1H,5'H)-dione
Smiles: C#CCN1c2c(Br)cc(cc2C2(C1=O)CC(=O)Nc1c2c(C)nn1c1ncnc2c1[nH]cn2)Cl

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Molecular Weight: 537.76
Empirical Formula: C22H14BrClN8O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.717
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 121
Number of rings: 6

     

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