COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150921
Chemical Name: 4-[(1Z)-1-{2-[({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-4-ium-2-yl}sulfanyl)acetyl]hydrazinylidene}propyl]phenolate
Smiles: CC/C(=N/NC(=O)CSc1n[nH+]c(s1)SCc1cccc2c1cccc2)/c1ccc(cc1)[O-]

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Molecular Weight: 494.66
Empirical Formula: C24H22N4O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.743
Rotatable bonds: 8
H-donors: 2
H-acceptors: 2
PSA: 170
Number of rings: 4

     

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