COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK370379
Chemical Name: 2-[(E)-(2-{[(1,3-benzodioxol-5-ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]-4,6-dibromophenyl1,3-benzodioxole-5-carboxylate(non-preferredname)
Smiles: O=C(CNC(=O)c1ccc2c(c1)OCO2)N/N=C/c1cc(Br)cc(c1OC(=O)c1ccc2c(c1)OCO2)Br

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Molecular Weight: 647.23
Empirical Formula: C25H17Br2N3O8

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 4.415
Rotatable bonds: 7
H-donors: 2
H-acceptors: 8
PSA: 133
Number of rings: 5

     

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