COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586109
Chemical Name: (4E)-4-(2-carbamothioylhydrazinylidene)-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylicacid
Smiles: NC(=S)N/N=C/1\CC(C)(C)Cc2c1c(C)c(o2)C(=O)O

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Molecular Weight: 295.36
Empirical Formula: C13H17N3O3S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 1.848
Rotatable bonds: 2
H-donors: 4
H-acceptors: 3
PSA: 132
Number of rings: 2

     

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