COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL155088
Chemical Name: N-({3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetyl)isoleucine
Smiles: CCC(C(C(=O)O)NC(=O)Cn1nc(ccc1=O)c1ccc(cc1)SC)C

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Molecular Weight: 389.48
Empirical Formula: C19H23N3O4S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 1.802
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 124
Number of rings: 2

     

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