COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK933742
Chemical Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-[(3-methoxypropyl)amino]cyclobut-3-ene-1,2-dione
Smiles: COCCCNC1=C(C(=O)C1=O)Nc1ccc2c(c1)OCCO2

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Molecular Weight: 318.33
Empirical Formula: C16H18N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.107
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 85
Number of rings: 3

     

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