COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK118818
Chemical Name: (3E)-3-{2-[(2,4-dibromo-5-methylphenoxy)acetyl]hydrazinylidene}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)butanamide
Smiles: O=C(COc1cc(C)c(cc1Br)Br)N/N=C(/CC(=O)Nc1ccc2c(c1)OCCO2)\C

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Molecular Weight: 555.22
Empirical Formula: C21H21Br2N3O5

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 4.131
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 98
Number of rings: 3

     

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