COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK513858
Chemical Name: 4-[(E)-(2-{(2E)-3-(1,3-benzodioxol-5-yl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}hydrazinylidene)methyl]-2-methoxyphenyl4-nitrobenzoate
Smiles: COc1cc(/C=N/NC(=O)/C(=C\c2ccc3c(c2)OCO3)/NC(=O)c2ccccc2)ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 608.56
Empirical Formula: C32H24N4O9

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 6.977
Rotatable bonds: 6
H-donors: 2
H-acceptors: 9
PSA: 170
Number of rings: 5

     

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