COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049222
Chemical Name: 4-{4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}-N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)c2ccc(cc2)Cl)/s1)C

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Molecular Weight: 500.04
Empirical Formula: C20H26ClN5O4S2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.608
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 3

     

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