COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK022654
Chemical Name: 1-(2-bromophenyl)-3,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Smiles: Brc1ccccc1n1nc(c2c1CC(C)(C)CC2=O)C

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Molecular Weight: 333.23
Empirical Formula: C16H17BrN2O

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 5.125
Rotatable bonds: 0
H-donors: 0
H-acceptors: 1
PSA: 34
Number of rings: 3

     

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