COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK394792
Chemical Name: 4-[(E)-(2-{(2E)-3-(1,3-benzodioxol-5-yl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}hydrazinylidene)methyl]-2-bromo-6-methoxyphenyl4-methylbenzoate
Smiles: COc1cc(/C=N/NC(=O)/C(=C\c2ccc3c(c2)OCO3)/NC(=O)c2ccccc2)cc(c1OC(=O)c1ccc(cc1)C)Br

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Molecular Weight: 656.49
Empirical Formula: C33H26BrN3O7

Physical State: Dry powder
Available Amount: 249 mg

Lipinsky:
logP: 8.584
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 124
Number of rings: 5

     

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