COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565117
Chemical Name: ethyl(3E)-3-[2-(4-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-6-methylpyrimidin-2-yl)hydrazinylidene]butanoate
Smiles: CCOC(=O)C/C(=N/Nc1nc(C)cc(n1)Sc1nnc(s1)SCC)/C

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Saltdata: CH3COOH
Molecular Weight: 412.56
Empirical Formula: C15H20N6O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.301
Rotatable bonds: 9
H-donors: 1
H-acceptors: 2
PSA: 181
Number of rings: 2

     

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