COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK311228
Chemical Name: (3aR,7aS)-2-[1-(2,6-dichlorobenzyl)-1H-1,2,4-triazol-3-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1[C@@H]2CCCC[C@@H]2C(=O)N1c1ncn(n1)Cc1c(Cl)cccc1Cl

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Molecular Weight: 379.25
Empirical Formula: C17H16Cl2N4O2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.208
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 68
Number of rings: 4

     

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