COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL156411
Chemical Name: 4-(1,3-benzodioxol-5-ylamino)-2-{[4-(2-cyanoethyl)piperazin-1-yl]methyl}-4-oxobutanoicacid
Smiles: N#CCCN1CCN(CC1)CC(C(=O)O)CC(=O)Nc1ccc2c(c1)OCO2

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Molecular Weight: 388.42
Empirical Formula: C19H24N4O5

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 0.57
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 115
Number of rings: 3

     

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