COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK587104
Chemical Name: 2-{[3-cyano-6-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl}-N-[(2E)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: CCSc1n[nH]/c(=N\C(=O)CSc2nc(ccc2C#N)c2ccc(c(c2)OC)OC)/s1

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Molecular Weight: 473.6
Empirical Formula: C20H19N5O3S3

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 3.352
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 184
Number of rings: 3

     

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