COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561673
Chemical Name: 2,6-dimethoxy-4-({4-[(2-methoxyphenyl)carbonyl]piperazin-1-ium-1-yl}methyl)phenolate
Smiles: COc1ccccc1C(=O)N1CC[NH+](CC1)Cc1cc(OC)c(c(c1)OC)[O-]

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Saltdata: (COOH)2
Molecular Weight: 386.45
Empirical Formula: C21H26N2O5

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 0.717
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 75
Number of rings: 3

     

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