COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL337020
Chemical Name: 4-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-N-carbamimidoylbenzenesulfonamide
Smiles: N#C/C(=C/Nc1ccc(cc1)S(=O)(=O)NC(=N)N)/c1scc(n1)c1ccc2c(c1)OCO2

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Molecular Weight: 468.52
Empirical Formula: C20H16N6O4S2

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.467
Rotatable bonds: 2
H-donors: 5
H-acceptors: 4
PSA: 199
Number of rings: 4

     

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