COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL057170
Chemical Name: 4-oxo-4-(4-{[4-(propan-2-yl)phenyl]sulfonyl}piperazin-1-yl)-N-[(2Z)-5-(trifluoromethyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C(F)(F)F)CCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(C)C

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Molecular Weight: 519.57
Empirical Formula: C20H24F3N5O4S2

Physical State: Dry powder
Available Amount: 169 mg

Lipinsky:
logP: 3.202
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 3

     

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