COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054219
Chemical Name: 4-{4-[(5-chloro-2-methoxyphenyl)sulfonyl]piperazin-1-yl}-4-oxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)c2cc(Cl)ccc2OC)/s1

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Molecular Weight: 516.04
Empirical Formula: C20H26ClN5O5S2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.374
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 154
Number of rings: 3

     

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