COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK311000
Chemical Name: (3aR,7aS)-2-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1[C@@H]2CCCC[C@@H]2C(=O)N1c1c(C)nn(c1C)Cc1ccccc1Cl

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Molecular Weight: 371.87
Empirical Formula: C20H22ClN3O2

Physical State: Dry powder
Available Amount: 27 mg

Lipinsky:
logP: 2.613
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 55
Number of rings: 4

     

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