COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL492922
Chemical Name: 2-(2,5-dimethyl-1H-pyrrol-1-yl)-1-[4-(2,3,4-trimethoxybenzyl)piperazin-1-yl]ethanone
Smiles: COc1c(ccc(c1OC)OC)CN1CCN(CC1)C(=O)Cn1c(C)ccc1C

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Molecular Weight: 401.51
Empirical Formula: C22H31N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.428
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 56
Number of rings: 3

     

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