COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042937
Chemical Name: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-(trifluoromethyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: Cc1ccc(c(c1)N1CCN(CC1)C(=O)CCC(=O)/N=c\1/[nH]nc(s1)C(F)(F)F)C

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Molecular Weight: 441.48
Empirical Formula: C19H22F3N5O2S

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 2.807
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 102
Number of rings: 3

     

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