COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL081470
Chemical Name: 5-(3-chloro-4-methoxyphenyl)-1-(4-methoxybenzyl)-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Smiles: COc1ccc(cc1)CN1N=NC2C1C(=O)N(C2=O)c1ccc(c(c1)Cl)OC

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Molecular Weight: 400.82
Empirical Formula: C19H17ClN4O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.798
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 83
Number of rings: 4

     

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