COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147844
Chemical Name: 3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]propanamide
Smiles: CC(Cc1n[nH]/c(=N\C(=O)CCN2C(=S)S/C(=C\c3ccc(cc3)C)/C2=O)/s1)C

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Molecular Weight: 446.62
Empirical Formula: C20H22N4O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.173
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 156
Number of rings: 3

     

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