COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043639
Chemical Name: 3-{(1E)-1-[2-({[5-(benzylsulfanyl)-1,3,4-thiadiazol-4-ium-2-yl]sulfanyl}acetyl)hydrazinylidene]ethyl}phenolate
Smiles: O=C(N/N=C(/c1cccc(c1)[O-])\C)CSc1n[nH+]c(s1)SCc1ccccc1

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Molecular Weight: 430.58
Empirical Formula: C19H18N4O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.997
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 170
Number of rings: 3

     

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