COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL086356
Chemical Name: N-{2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-2-oxoethyl}-N-(2,4-dimethoxyphenyl)-2-nitrobenzenesulfonamide(non-preferredname)
Smiles: COc1ccc(c(c1)OC)N(S(=O)(=O)c1ccccc1[N+](=O)[O-])CC(=O)N/N=C/c1ccc2c(c1)OCO2

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Molecular Weight: 542.53
Empirical Formula: C24H22N4O9S

Physical State: Dry powder
Available Amount: 72 mg

Lipinsky:
logP: 1.548
Rotatable bonds: 7
H-donors: 1
H-acceptors: 9
PSA: 169
Number of rings: 4

     

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