COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567375
Chemical Name: 4-oxo-4-(4-{[4-(propan-2-yl)phenyl]sulfonyl}piperazin-1-yl)-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)c2ccc(cc2)C(C)C)/s1

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Molecular Weight: 493.65
Empirical Formula: C22H31N5O4S2

Physical State: Dry powder
Available Amount: 275 mg

Lipinsky:
logP: 2.742
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 3

     

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