COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048609
Chemical Name: N-[(2E)-5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-ethylbutanamide
Smiles: CCC(C(=O)/N=c/1\[nH]nc(s1)c1ccc(c(c1)OC)OC)CC

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Molecular Weight: 335.43
Empirical Formula: C16H21N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.774
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 97
Number of rings: 2

     

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