COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL142185
Chemical Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][1-(3,5-dimethylphenyl)-1H-1,2,3-triazol-4-yl]methanone
Smiles: Cc1cc(C)cc(c1)n1nnc(c1)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 419.48
Empirical Formula: C23H25N5O3

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 2.254
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 72
Number of rings: 5

     

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