COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK361889
Chemical Name: 2-[(E)-{2-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]phenyl4-nitrobenzenesulfonate
Smiles: O=C(CSc1nc2c(s1)cccc2)N/N=C/c1ccccc1OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 528.59
Empirical Formula: C22H16N4O6S3

Physical State: Dry powder
Available Amount: 223 mg

Lipinsky:
logP: 5.853
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 205
Number of rings: 4

     

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